Compound Identification
SMILES
C\C(NC1=CC=CC(C)=C1C)=C1/C(=O)OC(C)=CC1=O
InChIKey
InChIKey=UWAPUCCLQMJKRU-NTCAYCPXSA-N
Formula
C16H17NO3
Mass
271.316
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Xylenes
Intermediate Tree Nodes
Not available
Direct Parent
o-Xylenes
Alternative Parents
Aniline and substituted anilines Dihydropyranones Vinylogous amides Enol esters Enoate esters Amino acids and derivatives Lactones Cyclic ketones Secondary amines Oxacyclic compounds Monocarboxylic acids and derivatives Enamines Hydrocarbon derivatives Organic oxides Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aniline or substituted anilines - O-xylene - Dihydropyranone - Enol ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Ketone - Lactone - Cyclic ketone - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Secondary amine - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aldehyde - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-xylenes. These are aromatic compounds that contain a o-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 2-positions.
External Descriptors
Not available