Compound Identification
SMILES
CC1=NC=C(N1CCN1C(=O)\C(=C\C2=CC(Cl)=CC=C2)N=C1C1=CC=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=WKTMQLBCBBEGPX-UYRXBGFRSA-N
Formula
C22H18ClN5O3
Mass
435.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
1,2,5-trisubstituted imidazoles Nitroimidazoles Nitroaromatic compounds Chlorobenzenes Aryl chlorides Imidazolinones N-substituted imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxamidines Carboximidamides Organic oxoazanium compounds Carbonyl compounds Organic salts Organochlorides Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - 1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Trisubstituted imidazole - Nitroimidazole - Chlorobenzene - Halobenzene - Aryl chloride - Monocyclic benzene moiety - Imidazolinone - Aryl halide - N-substituted imidazole - Benzenoid - Imidazole - Heteroaromatic compound - Azole - 2-imidazoline - Organic nitro compound - C-nitro compound - Carboxylic acid amidine - Organic oxoazanium - Carboximidamide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Amidine - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available