Compound Identification
SMILES
OC1=CC(=O)C=C\C1=C/NNC(=O)C(CSCC1=CC=CC=C1)NC(=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=HHYHCXHHEUAMJK-QGOAFFKASA-N
Formula
C24H22N4O6S
Mass
494.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Benzamides
- Level 6 Hippuric acids and derivatives
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Level 5
Benzamides
-
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
N-acyl-alpha amino acids and derivatives Cysteine and derivatives Nitrobenzenes P-quinomethanes Benzoyl derivatives Nitroaromatic compounds Vinylogous acids Secondary carboxylic acid amides Carboxylic acid hydrazides Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Dialkylthioethers Enols Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Cysteine or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - P-quinomethane - Quinomethane - Vinylogous acid - Organic nitro compound - Carboxamide group - Carboxylic acid hydrazide - Cyclic ketone - Ketone - C-nitro compound - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Dialkylthioether - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Enol - Sulfenyl compound - Thioether - Organic oxoazanium - Carbonyl group - Organic oxygen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic homomonocyclic 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