Compound Identification
SMILES
COC(=O)C1=CC=C(OCC(O)CN(CC2=CC=CC=C2)CC2=CC=CC=C2)C=C1
InChIKey
InChIKey=QLBVCVLDEMIUFX-UHFFFAOYSA-N
Formula
C25H27NO4
Mass
405.494
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
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
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoate ester - Phenoxy compound - Benzoyl - Benzylamine - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Methyl ester - Secondary alcohol - Tertiary aliphatic amine - 1,2-aminoalcohol - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Ether - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Amine - Organic nitrogen 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