Compound Identification
SMILES
COC1=CC=C(C=C1)S(=O)(=O)NC(CNC(=O)C1=CC(F)=C(C=C1)N1CCCC(C1)NC1=NC=CC=N1)C(=O)OC(C)(C)C
InChIKey
InChIKey=ZRXOZGHQSDIWHM-UHFFFAOYSA-N
Formula
C30H37FN6O6S
Mass
628.72
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid esters
Alternative Parents
Phenylpiperidines 3-halobenzoic acids and derivatives Aminobenzamides Benzenesulfonamides Benzamides Benzenesulfonyl compounds Aniline and substituted anilines Phenoxy compounds Anisoles Methoxybenzenes Benzoyl derivatives Dialkylarylamines Alkyl aryl ethers Aminopiperidines Fluorobenzenes Aminopyrimidines and derivatives Organosulfonamides Aryl fluorides Heteroaromatic compounds Aminosulfonyl compounds Secondary carboxylic acid amides Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Phenylpiperidine - Aminobenzamide - Aminobenzoic acid or derivatives - Benzenesulfonamide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzenesulfonyl group - Benzamide - Benzoic acid or derivatives - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Anisole - Tertiary aliphatic/aromatic amine - Benzoyl - Phenol ether - Phenoxy compound - 3-aminopiperidine - Halobenzene - Aminopyrimidine - Alkyl aryl ether - Fluorobenzene - Pyrimidine - Piperidine - Monocyclic benzene moiety - Organosulfonic acid amide - Aryl halide - Aryl fluoride - Benzenoid - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary amine - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Ether - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available