Compound Identification
SMILES
OC(=O)C(O)=O.COC1=CC=CC(=C1)C(=O)N1CCN(CC2=C(OC)C=CC(Br)=C2)CC1
InChIKey
InChIKey=HGMNKQSPAYKULL-UHFFFAOYSA-N
Formula
C22H25BrN2O7
Mass
509.353
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 Benzamides
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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
Benzamides
Alternative Parents
Phenylmethylamines Phenoxy compounds Methoxybenzenes Anisoles Benzylamines Benzoyl derivatives Alkyl aryl ethers N-alkylpiperazines Aralkylamines Bromobenzenes Dicarboxylic acids and derivatives Aryl bromides Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Carboxylic acids Azacyclic compounds Organobromides Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Benzamide - Phenol ether - Phenylmethylamine - Benzylamine - Benzoyl - Methoxybenzene - Anisole - Phenoxy compound - Halobenzene - N-alkylpiperazine - Aralkylamine - Alkyl aryl ether - Bromobenzene - 1,4-diazinane - Dicarboxylic acid or derivatives - Aryl halide - Aryl bromide - Piperazine - Tertiary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Ether - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzamides. These are organic compounds containing a carboxamido substituent attached to a benzene ring.
External Descriptors
Not available