Compound Identification
SMILES
COC(=O)C1=CC=CC(=C1)C1=CC=C(O1)C=C1C(=O)NN(C1=O)C1=CC=C(Br)C=C1
InChIKey
InChIKey=NUTPWDDHYLOWFB-UHFFFAOYSA-N
Formula
C22H15BrN2O5
Mass
467.275
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Benzoyl derivatives Bromobenzenes Pyrazolidinones Aryl bromides Methyl esters Heteroaromatic compounds Furans Carboxylic acid hydrazides Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Benzoyl - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Pyrazolidinone - Heteroaromatic compound - Furan - Methyl ester - Pyrazolidine - Carboxylic acid ester - Carboxylic acid hydrazide - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - 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