Compound Identification
SMILES
CC1=C(\C=C\CN2CCN3C(COC4=C3C=C(F)C=C4)C2)C=NN1C1=NC(N)=CC(Cl)=N1
InChIKey
InChIKey=XXLNTFDESATENK-NSCUHMNNSA-N
Formula
C22H23ClFN7O
Mass
455.92
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
Benzomorpholines Dialkylarylamines Alkyl aryl ethers Aminopyrimidines and derivatives N-alkylpiperazines Halopyrimidines Aryl chlorides Aryl fluorides Imidolactams Benzenoids Pyrazoles Heteroaromatic compounds Trialkylamines Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organochlorides Organofluorides Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzomorpholine - Benzoxazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Alkyl aryl ether - Aminopyrimidine - Halopyrimidine - N-alkylpiperazine - Aryl chloride - Aryl fluoride - Aryl halide - 1,4-diazinane - Oxazinane - Piperazine - Pyrimidine - Benzenoid - Imidolactam - Azole - Pyrazole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Oxacycle - Ether - Organopnictogen compound - Organohalogen compound - Hydrocarbon derivative - Primary amine - Organochloride - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - 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