Compound Identification
SMILES
CC1=CC=C(CN(CCC2=CNC3=CC=CC=C23)C(=O)CN(CC2=CC=C(F)C=C2)C(=O)C2=C(Cl)C=C(C=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=AJJHTQDHCYJULJ-UHFFFAOYSA-N
Formula
C34H30ClFN4O4
Mass
613.09
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
2-halobenzoic acids and derivatives 3-alkylindoles Alpha amino acids and derivatives Nitrobenzenes Benzoyl derivatives Nitroaromatic compounds Chlorobenzenes Fluorobenzenes Toluenes Aryl chlorides Aryl fluorides Substituted pyrroles Tertiary carboxylic acid amides Vinylogous halides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carbonyl compounds Organic salts Organonitrogen compounds Organic zwitterions Organochlorides Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hippuric acid or derivatives - Alpha-amino acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-alkylindole - Nitrobenzene - Indole or derivatives - Indole - Nitroaromatic compound - Benzoyl - Toluene - Halobenzene - Fluorobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Substituted pyrrole - Aryl fluoride - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous halide - Pyrrole - Carboxamide group - Organic nitro compound - C-nitro compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Organic oxygen compound - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Organochloride - Aromatic heteropolycyclic 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