Compound Identification
SMILES
CC[NH+]1CCC2=C(C1)SC(NC(=O)\C=C/C1=CC=C(C=C1)[N+]([O-])=O)=C2C(=O)OC
InChIKey
InChIKey=OEKOVXMRCFLINQ-TWGQIWQCSA-O
Formula
C20H22N3O5S
Mass
416.47
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
Thienopyridines Nitrobenzenes Thiophene carboxylic acids and derivatives Styrenes Nitroaromatic compounds N-arylamides Aralkylamines Vinylogous amides Quaternary ammonium salts Methyl esters Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Organic oxoazanium compounds Azacyclic compounds Organic salts Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid amide - Nitrobenzene - Thienopyridine - Nitroaromatic compound - Styrene - Thiophene carboxylic acid or derivatives - N-arylamide - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Quaternary ammonium salt - Heteroaromatic compound - Vinylogous amide - Thiophene - Methyl ester - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Tertiary amine - Organic nitro compound - Tertiary aliphatic amine - Organic oxoazanium - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Amine - Organic salt - Organic cation - Aromatic heteropolycyclic 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