Compound Identification
SMILES
CC1=CC=C(C=C1)S([O-])(=O)=O.CC1=CC=C(C=C1)S([O-])(=O)=O.CCC[N+]1=CC=CC2=C1C=C(NC(=O)\C=C\C1=CC=C(C=C1)C(=O)NC1=CC3=C(C=CC=[N+]3CCC)C=C1)C=C2
InChIKey
InChIKey=WBMHAOUFLAPEKQ-UMVVUDSKSA-N
Formula
C48H48N4O8S2
Mass
873.05
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid amides
-
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
p-Methylbenzenesulfonates Tosyl compounds Quinolines and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzamides Benzenesulfonyl compounds Styrenes Benzoyl derivatives N-arylamides Pyridinium derivatives Sulfonyls Heteroaromatic compounds Organosulfonic acids Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Not available
Substituents
Cinnamic acid amide - P-methylbenzenesulfonate - Quinoline - Benzenesulfonate - Tosyl compound - Arylsulfonic acid or derivatives - Benzamide - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - Benzoic acid or derivatives - N-arylamide - Styrene - Benzoyl - Toluene - Monocyclic benzene moiety - Pyridinium - Benzenoid - Pyridine - Heteroaromatic compound - Sulfonyl - Organosulfonic acid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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