Compound Identification
SMILES
COCCN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C)C=C1)C(=O)C1=CC(Cl)=CC(Cl)=C1
InChIKey
InChIKey=FQJSEJFKFQVYIX-UHFFFAOYSA-N
Formula
C30H31Cl2N3O3
Mass
552.5
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
3-alkylindoles 3-halobenzoic acids and derivatives Alpha amino acids and derivatives Dichlorobenzenes Benzoyl derivatives Toluenes Substituted pyrroles Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Azacyclic compounds Dialkyl ethers Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hippuric acid or derivatives - Alpha-amino acid or derivatives - 3-halobenzoic acid or derivatives - 3-alkylindole - Halobenzoic acid or derivatives - Indole - Indole or derivatives - Benzoyl - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Toluene - Substituted pyrrole - Aryl chloride - Aryl halide - Pyrrole - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Dialkyl ether - Organooxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - 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