Compound Identification
SMILES
CCN1N=CC(C(=O)C=CC2=CC(OC)=C(O)C(Br)=C2)=C1C
InChIKey
InChIKey=UVKAJEWPCYRDKH-UHFFFAOYSA-N
Formula
C16H17BrN2O3
Mass
365.227
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Hydroxycinnamic acids and derivatives
Alternative Parents
Methoxyphenols Styrenes Phenoxy compounds Anisoles O-bromophenols Methoxybenzenes Aryl ketones Alkyl aryl ethers Bromobenzenes Aryl bromides Vinylogous amides Pyrazoles Acryloyl compounds Heteroaromatic compounds Enones Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydroxycinnamic acid or derivatives - Methoxyphenol - 2-bromophenol - Phenoxy compound - Anisole - Phenol ether - Styrene - Aryl ketone - Methoxybenzene - 2-halophenol - Alkyl aryl ether - Phenol - Bromobenzene - Halobenzene - Monocyclic benzene moiety - Benzenoid - Aryl bromide - Aryl halide - Acryloyl-group - Azole - Heteroaromatic compound - Enone - Vinylogous amide - Alpha,beta-unsaturated ketone - Pyrazole - Ketone - Organoheterocyclic compound - Ether - Azacycle - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. These are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated.
External Descriptors
Not available