Compound Identification
SMILES
CCOC(=O)C1=CC=C(NC[C@@H](O)COC2=CC=CC=C2)C=C1
InChIKey
InChIKey=AEAHERKUIKJFSJ-MRXNPFEDSA-N
Formula
C18H21NO4
Mass
315.369
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
Aminobenzoic acids and derivatives Aniline and substituted anilines Benzoyl derivatives Phenol ethers Phenoxy compounds Phenylalkylamines Alkyl aryl ethers Secondary alkylarylamines Carboxylic acid esters Amino acids and derivatives 1,2-aminoalcohols Secondary alcohols Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoate ester - Aminobenzoic acid or derivatives - Benzoyl - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Phenoxy compound - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Secondary alcohol - 1,2-aminoalcohol - Carboxylic acid ester - Amino acid or derivatives - Monocarboxylic acid or derivatives - Secondary amine - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Alcohol - 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