Compound Identification
SMILES
CC1(C)OC([O-])=C(C(C(C#N)C(N)=O)C2=CC=CC=C2)C(=O)O1
InChIKey
InChIKey=YGVPQBXRLKSZQR-UHFFFAOYSA-M
Formula
C16H15N2O5
Mass
315.306
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
- Class Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Ethers
Intermediate Tree Nodes
Acetals
Direct Parent
Ketals
Alternative Parents
Benzene and substituted derivatives Fatty amides Vinylogous esters Vinylogous acids Enoate esters Primary carboxylic acid amides Ketene acetals Lactones Oxacyclic compounds Nitriles Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds Organopnictogen compounds Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Ketal - Monocyclic benzene moiety - Fatty amide - Benzenoid - Fatty acyl - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous acid - Vinylogous ester - Carboxamide group - Carboxylic acid ester - Ketene acetal or derivatives - Lactone - Primary carboxylic acid amide - Carboxylic acid derivative - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Organonitrogen compound - Carbonyl group - Organopnictogen compound - Organic nitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organic anion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as ketals. These are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals.
External Descriptors
Not available