Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=C1)[C@@H]1OC2=C(C=C(Cl)C=C2)[C@H]2CC(=NN12)C1=CC2=CC=CC=C2C=C1
InChIKey
InChIKey=MRKKITPQJQBXCT-RSXGOPAZSA-N
Formula
C26H18ClN3O3
Mass
455.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazines
Alternative Parents
Naphthalenes Nitrobenzenes Nitroaromatic compounds Aryl chlorides Pyrazolines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Hydrazones Organic oxoazanium compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Organic salts Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazine - Naphthalene - Nitrobenzene - Nitroaromatic compound - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrazoline - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrazone - Oxacycle - Azacycle - Organic oxoazanium - Organic salt - Organic oxygen compound - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazines. These are organic compounds containing a benzene fused to an oxazine ring (a six-membered aliphatic ring with four carbon atoms, one oxygen atom, and one nitrogen atom).
External Descriptors
Not available