Compound Identification
SMILES
CCOC(=O)C1=CC=C(C=C1)N1C(C2=C(C)NN=C2C1=O)C1=CC(OC)=C(OC)C=C1
InChIKey
InChIKey=PHPWDBPNYJMORL-UHFFFAOYSA-N
Formula
C23H23N3O5
Mass
421.453
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
Dimethoxybenzenes Pyrrolopyrazoles Phenoxy compounds 2-heteroaryl carboxamides Anisoles Benzoyl derivatives Alkyl aryl ethers Tertiary carboxylic acid amides Pyrroles Pyrazoles Heteroaromatic compounds Carboxylic acid esters Lactams Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Dimethoxybenzene - O-dimethoxybenzene - 2-heteroaryl carboxamide - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Pyrrolopyrazole - Methoxybenzene - Alkyl aryl ether - Azole - Pyrazole - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Lactam - Carboxylic acid ester - Carboxamide group - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Aromatic heteropolycyclic 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