Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(S1)C(=O)COC(=O)C(=C\C1=C(C)N(C[C@@H]2CCCO2)C(C)=C1)\C#N

InChIKey

InChIKey=JHAMZWXQASIYSZ-VBIXMBBUSA-N

Formula

C22H24N2O4S

Mass

412.5

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones

Direct Parent

Aryl alkyl ketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl alkyl ketone - Fatty acid ester - 2,5-disubstituted thiophene - Alpha-acyloxy ketone - Substituted pyrrole - Fatty acyl - Oxolane - Pyrrole - Heteroaromatic compound - Thiophene - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organoheterocyclic compound - Azacycle - Oxacycle - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Cyanide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.

External Descriptors

Not available

Previous Back Next