Compound Identification
SMILES
ClC1=CC=C(C=C1)C1=NN2C(C1)C1=C(OC22C(=O)N(CC3=CC=CC=C3)C3=CC=CC=C23)C=CC(Br)=C1
InChIKey
InChIKey=CHVYGZOLBKOSBQ-UHFFFAOYSA-N
Formula
C30H21BrClN3O2
Mass
570.87
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
Alpha amino acids and derivatives Indoles and derivatives Chlorobenzenes Aryl bromides Aryl chlorides Tertiary carboxylic acid amides Pyrazolines Lactams Oxacyclic compounds Azacyclic compounds Hydrazones Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzoxazine - Indole or derivatives - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Pyrazoline - Carboxamide group - Lactam - Hydrazone - Carboxylic acid derivative - Azacycle - Oxacycle - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - 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