Compound Identification
SMILES
CC1C2(OC(=N)C1(C#N)C(C#N)(C#N)C(O2)C1=C(C)C=C(C)C=C1)C1=CC=C(C)C=C1
InChIKey
InChIKey=QSZXJNSDWAVJLK-UHFFFAOYSA-N
Formula
C25H22N4O2
Mass
410.477
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
m-Xylenes
Alternative Parents
Toluenes Ketals 1,3-dioxepanes Oxanes Oxolanes Imidoesters Oxacyclic compounds Nitriles Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
M-xylene - 1,3-dioxepane - Dioxepane - Toluene - Ketal - Oxane - Oxolane - Imido ester - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Acetal - Cyanide - Organic nitrogen compound - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as m-xylenes. These are aromatic compounds that contain a m-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 3-positions.
External Descriptors
Not available