Compound Identification
SMILES
COC(=O)C1=CC=C(NC2=NC3=C(C=C(C=C3)C(=O)N(CCC(C)C)CCC(C)C)N2CC2CCNCC2)C=C1
InChIKey
InChIKey=NRWWPCXHVDWLCZ-UHFFFAOYSA-N
Formula
C32H45N5O3
Mass
547.744
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
Benzimidazoles Aniline and substituted anilines Benzoyl derivatives Piperidines Aminoimidazoles N-substituted imidazoles Tertiary carboxylic acid amides Methyl esters Heteroaromatic compounds Tertiary amines Amino acids and derivatives Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Benzimidazole - Aniline or substituted anilines - Benzoyl - Aminoimidazole - Piperidine - N-substituted imidazole - Azole - Heteroaromatic compound - Methyl ester - Tertiary carboxylic acid amide - Imidazole - Amino acid or derivatives - Tertiary amine - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Organonitrogen 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