Compound Identification
SMILES
COC(=O)C1=CC=C(C[C@H](C)NC[C@H](O)C2=CC(Cl)=CC=C2)C=C1
InChIKey
InChIKey=RWHBDKHCOSWIBB-UGSOOPFHSA-N
Formula
C19H22ClNO3
Mass
347.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Amphetamines and derivatives Phenylpropanes Benzoyl derivatives Chlorobenzenes Aralkylamines Aryl chlorides Methyl esters Secondary alcohols Amino acids and derivatives 1,2-aminoalcohols Dialkylamines Organochlorides Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Amphetamine or derivatives - Benzoate ester - Phenylpropane - Benzoyl - Chlorobenzene - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Methyl ester - Secondary alcohol - Amino acid or derivatives - 1,2-aminoalcohol - Carboxylic acid ester - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Aromatic alcohol - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Alcohol - Organochloride - Organic nitrogen compound - Organonitrogen compound - Amine - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available