Compound Identification
SMILES
[I-].CN1C2=CC=CC=[N+]2C(C(=O)C2=CC=CC=C2)=C(C=C1C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=RTTMYPFDSLJSMU-UHFFFAOYSA-M
Formula
C29H23IN2O
Mass
542.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Pyridodiazepines Benzoyl derivatives Aryl ketones 1,3-diazepines Pyridinium derivatives Heteroaromatic compounds Enamines Azacyclic compounds Organic oxides Organic iodide salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Pyrido-meta-diazepine - Benzoyl - Aryl ketone - Meta-diazepine - Monocyclic benzene moiety - Pyridine - Pyridinium - Benzenoid - Heteroaromatic compound - Ketone - Enamine - Azacycle - Organoheterocyclic compound - Organic iodide salt - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available