Compound Identification
SMILES
CCOC(=O)C1=C(N=C2SC(=CC3=CC(Br)=C(O3)N3CCOCC3)C(=O)N2C1C1=CC(OC)=C(OC)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=LLHLGYTVKFLKDX-UHFFFAOYSA-N
Formula
C32H30BrN3O7S
Mass
680.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
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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
Dimethoxybenzenes Phenoxy compounds Anisoles Dialkylarylamines Alkyl aryl ethers Aryl bromides Morpholines Thiazoles Enoate esters Furans Heteroaromatic compounds Isothioureas Lactams Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Organobromides Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Methoxybenzene - Dialkylarylamine - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Morpholine - Oxazinane - Monocyclic benzene moiety - Benzenoid - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Thiazole - Furan - Azole - Heteroaromatic compound - Carboxylic acid ester - Isothiourea - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organobromide - Organic oxide - Hydrocarbon derivative - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen 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