Compound Identification
SMILES
COC(=O)C(\NC(=C)C1=C(F)C(N(C)C)=C(Cl)C=C1)=C(/C=C)\C(\N)=N\CC1=CC=CO1
InChIKey
InChIKey=SOVJMFVPGPBCOG-CYVLTUHYSA-N
Formula
C22H24ClFN4O3
Mass
446.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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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
Styrenes Aniline and substituted anilines Dialkylarylamines Chlorobenzenes Fatty acid esters Fluorobenzenes Aryl chlorides Aryl fluorides Enoate esters Methyl esters Heteroaromatic compounds Furans Carboxamidines Carboximidamides Propargyl-type 1,3-dipolar organic compounds Dialkylamines Oxacyclic compounds Monocarboxylic acids and derivatives Enamines Carbonyl compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Styrene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Fluorobenzene - Fatty acid ester - Chlorobenzene - Aryl fluoride - Aryl chloride - Benzenoid - Aryl halide - Fatty acyl - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Furan - Heteroaromatic compound - Carboxylic acid ester - Tertiary amine - Amidine - Oxacycle - Carboxylic acid amidine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Secondary aliphatic amine - Enamine - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Secondary amine - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Amine - Organooxygen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - 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