Compound Identification
SMILES
COC1=CC=CC=C1C1(C)CC(NC2=C(Cl)N=CC=C2)C(=O)O1
InChIKey
InChIKey=KXUAXTVBIXOFCP-UHFFFAOYSA-N
Formula
C17H17ClN2O3
Mass
332.78
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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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
Phenoxy compounds Anisoles Methoxybenzenes Secondary alkylarylamines 2-halopyridines Alkyl aryl ethers Aminopyridines and derivatives Aralkylamines Aryl chlorides Gamma butyrolactones Oxolanes Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - 2-halopyridine - Aminopyridine - Secondary aliphatic/aromatic amine - Aralkylamine - Gamma butyrolactone - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Pyridine - Benzenoid - Heteroaromatic compound - Oxolane - Lactone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Oxacycle - Secondary amine - Ether - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen 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