Compound Identification
SMILES
Cl.CCOC(=O)CN1CCN(CC1)C(=O)C1(CCN(CC[C@@]2(CCN(C2)C(=O)C2=CC(OC)=C(OC)C(OC)=C2)C2=CC(Cl)=C(Cl)C=C2)CC1)C1=CC=CC=C1
InChIKey
InChIKey=CYWDQVCXSNTEHN-YZNDQDBRSA-N
Formula
C42H53Cl3N4O7
Mass
832.26
Taxonomic Classification
Taxonomy Tree
-
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
-
Level 5
Amino acids and derivatives
-
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 Phenylpyrrolidines Phenylacetamides Benzamides Piperidinecarboxamides Anisoles Benzoyl derivatives Dichlorobenzenes Methoxybenzenes N-acylpyrrolidines Phenoxy compounds Aralkylamines Alkyl aryl ethers N-alkylpiperazines Aryl chlorides Tertiary carboxylic acid amides Pyrroles Carboxylic acid esters Trialkylamines Azacyclic compounds Monocarboxylic acids and derivatives Hydrochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Phenylpiperidine - 3-phenylpyrrolidine - Phenylacetamide - Piperidinecarboxamide - Benzoic acid or derivatives - Benzamide - Methoxybenzene - Phenol ether - Phenoxy compound - N-acylpyrrolidine - Benzoyl - Anisole - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - N-alkylpiperazine - Aralkylamine - Alkyl aryl ether - Piperidine - 1,4-diazinane - Piperazine - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Pyrrolidine - Pyrrole - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Ether - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Organic oxide - Amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrochloride - Hydrocarbon derivative - Organochloride - Organohalogen 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