Compound Identification
SMILES
COC1=CC(=C\C(=C\NNC(=O)C(C)NC2=CC=C(Cl)C=C2)C1=O)[N+]([O-])=O
InChIKey
InChIKey=CHULURVNRDRJKW-LUAWRHEFSA-N
Formula
C17H17ClN4O5
Mass
392.8
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alanine and derivatives
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Level 6
Alpha amino acids and derivatives
-
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 - Alpha amino acids and derivatives
Direct Parent
Alanine and derivatives
Alternative Parents
Aniline and substituted anilines O-quinomethanes Phenylalkylamines Chlorobenzenes Secondary alkylarylamines Aryl chlorides Vinylogous amides Carboxylic acid hydrazides C-nitro compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alanine or derivatives - Phenylalkylamine - Aniline or substituted anilines - O-quinomethane - Quinomethane - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Cyclic ketone - Carboxylic acid hydrazide - Organic nitro compound - Ketone - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic 1,3-dipolar compound - Organic oxoazanium - Organic zwitterion - Organohalogen compound - Amine - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic salt - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available