Compound Identification
SMILES
CC(C)(C)OC(=O)CC1CC(CC#N)OB(O1)C1=CC=CC=C1
InChIKey
InChIKey=IQJDRZRUUOWNER-UHFFFAOYSA-N
Formula
C17H22BNO4
Mass
315.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzene and substituted derivatives
Alternative Parents
Boronic acid esters Carboxylic acid esters Oxacyclic compounds Organic metalloid salts Nitriles Monocarboxylic acids and derivatives Organometalloid compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Monocyclic benzene moiety - Boronic acid ester - Boronic acid derivative - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organoheterocyclic compound - Organic metalloid salt - Oxacycle - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organic metalloid moeity - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
External Descriptors
Not available