Compound Identification
SMILES
Cl.CC1=CC(\C=C\C(=O)N2CCN(CC3=CC=C(COC4=CC=C(Cl)C=C4)C=C3)CC2)=CC(C)=C1OC1=NC=C(OCC2=CC=C(C=C2)C#N)C=C1
InChIKey
InChIKey=DRKZXWDCSRVALS-NWBUNABESA-N
Formula
C42H40Cl2N4O4
Mass
735.71
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
Diarylethers Benzonitriles Benzylamines m-Xylenes Phenol ethers Phenoxy compounds Phenylmethylamines Styrenes Alkyl aryl ethers Chlorobenzenes Aralkylamines N-alkylpiperazines Aryl chlorides Pyridines and derivatives Heteroaromatic compounds Tertiary carboxylic acid amides Amino acids and derivatives Trialkylamines Azacyclic compounds Nitriles Hydrochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Diaryl ether - Phenoxy compound - M-xylene - Xylene - Phenol ether - Benzonitrile - Benzylamine - Phenylmethylamine - Styrene - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperazine - Pyridine - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Nitrile - Carbonitrile - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Hydrochloride - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Cyanide - Organic oxide - Aromatic heteromonocyclic 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