Compound Identification
SMILES
COC(=O)C1=CC=CC=C1OCC(N)=[NH+]NC1=NC(Cl)=CC=C1
InChIKey
InChIKey=QEYPZAUPNZKEMU-UHFFFAOYSA-O
Formula
C15H16ClN4O3
Mass
335.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
-
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
Phenoxy compounds Phenol ethers Benzoyl derivatives 2-halopyridines Alkyl aryl ethers Imidolactams Aryl chlorides Methyl esters Heteroaromatic compounds Amidrazones Azacyclic compounds Carboximidamides Carboxamidines Hydrocarbon derivatives Organochlorides Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - 2-halopyridine - Aryl chloride - Aryl halide - Imidolactam - Pyridine - Heteroaromatic compound - Methyl ester - Carboxylic acid amidrazone - Carboxylic acid ester - Amidine - Azacycle - Organoheterocyclic compound - Carboxylic acid amidine - Carboxylic acid derivative - Ether - Carboximidamide - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteromonocyclic 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