Compound Identification
SMILES
COC(=O)C1=C(OCC2=CC=CC=C2)C=CC(=C1)C(O)CN(CC1=CC=CC=C1)C(C)(C)C
InChIKey
InChIKey=WNSVAMZMWBBXHT-UHFFFAOYSA-N
Formula
C28H33NO4
Mass
447.575
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines Benzoyl derivatives Aralkylamines Alkyl aryl ethers Methyl esters Trialkylamines Secondary alcohols Amino acids and derivatives 1,2-aminoalcohols Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoate ester - Benzylamine - Phenol ether - Phenylmethylamine - Benzoyl - Phenoxy compound - Aralkylamine - Alkyl aryl ether - Methyl ester - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - 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