Compound Identification
SMILES
FC1=CC=C(\C=C\C(=O)\C=C2/NC3=CC=CC=C3OC2=O)C=C1
InChIKey
InChIKey=IJMNYENKQYXUIY-CRWKAAGYSA-N
Formula
C18H12FNO3
Mass
309.296
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
Benzomorpholines Benzoxazines Alpha amino acids and derivatives Styrenes Fluorobenzenes Aryl fluorides Vinylogous amides Enoate esters Enones Acryloyl compounds Ketones Lactones Azacyclic compounds Oxacyclic compounds Enamines Monocarboxylic acids and derivatives Secondary amines Hydrocarbon derivatives Organic oxides Organofluorides Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Alpha-amino acid or derivatives - Benzomorpholine - Benzoxazine - Styrene - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Oxazinane - Benzenoid - Enone - Acryloyl-group - Alpha,beta-unsaturated carboxylic ester - Alpha,beta-unsaturated ketone - Vinylogous amide - Enoate ester - Amino acid or derivatives - Lactone - Ketone - Carboxylic acid ester - Enamine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Secondary amine - Azacycle - Oxacycle - Amine - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aldehyde - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - 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