Compound Identification
SMILES
CC1=CC(C)=C(C=C1)N1N=C(C=C1NC(=O)CN(CC1=CC=CC=C1)C(=O)C1=CC=C(C=C1)[N+]([O-])=O)C(C)(C)C
InChIKey
InChIKey=GANXZPAZJXRETA-UHFFFAOYSA-N
Formula
C31H33N5O4
Mass
539.636
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
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Level 5
Benzamides
- Level 6 Hippuric acids and derivatives
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Level 5
Benzamides
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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
Benzamides
Direct Parent
Hippuric acids and derivatives
Alternative Parents
Phenylpyrazoles Alpha amino acids and derivatives Nitrobenzenes m-Xylenes Benzoyl derivatives N-arylamides Nitroaromatic compounds Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hippuric acid or derivatives - Phenylpyrazole - Alpha-amino acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - M-xylene - Xylene - N-arylamide - Azole - Heteroaromatic compound - Pyrazole - Tertiary carboxylic acid amide - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic salt - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic zwitterion - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.
External Descriptors
Not available