Compound Identification
SMILES
O=CC(=O)C1=CC=C(C=C1)C1=NNN=N1
InChIKey
InChIKey=PBEHFFUTZHGPIR-UHFFFAOYSA-N
Formula
C9H6N4O2
Mass
202.173
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Tetrazoles
- Level 5 Phenyltetrazoles and derivatives
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Subclass
Tetrazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Tetrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenyltetrazoles and derivatives
Alternative Parents
Phenylacetaldehydes Benzoyl derivatives Aryl ketones Heteroaromatic compounds Alpha ketoaldehydes Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyltetrazole - Phenylacetaldehyde - Benzoyl - Aryl ketone - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Alpha-ketoaldehyde - Ketone - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aldehyde - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyltetrazoles and derivatives. These are compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.
External Descriptors
Not available