Compound Identification
SMILES
CCOC(=O)C1=C(N=C2SC(=CC3=CC(I)=C(OC)C=C3)C(=O)N2C1C1=CC(OC)=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=KCHDGTBUUVIMIM-UHFFFAOYSA-N
Formula
C30H25IN2O5S
Mass
652.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
-
Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid esters
Alternative Parents
Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Iodobenzenes Aryl iodides Thiazoles Enoate esters Heteroaromatic compounds Lactams Isothioureas Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organoiodides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Iodobenzene - Halobenzene - Aryl halide - Aryl iodide - Benzenoid - Monocyclic benzene moiety - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Thiazole - Heteroaromatic compound - Azole - Carboxylic acid ester - Isothiourea - Lactam - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organohalogen compound - Organoiodide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
External Descriptors
Not available