Compound Identification
SMILES
CN(C)C1=C(Br)C=C(C=C(C#N)C(=O)NC2=CC=C(Cl)C=C2)C=C1
InChIKey
InChIKey=JLKNVTUMFFBHSI-UHFFFAOYSA-N
Formula
C18H15BrClN3O
Mass
404.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid amides
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Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid amides
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid amides
Alternative Parents
Anilides 2-bromoanilines Dialkylarylamines N-arylamides Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides Amino acids and derivatives Secondary carboxylic acid amides Nitriles Organic oxides Carbonyl compounds Organobromides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid amide - Anilide - Tertiary aliphatic/aromatic amine - N-arylamide - 2-bromoaniline - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Bromobenzene - Chlorobenzene - Benzenoid - Aryl bromide - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Nitrile - Carbonitrile - Carboxylic acid derivative - Amine - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid amides. These are amides of cinnamic acids. Cinnamic acid is an aromatic compound containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available