Compound Identification
SMILES
COC1=CC=C(CN2CCOC3=C2C=C(Cl)C=C3C(=O)NC2CN3CCC2CC3)C=C1
InChIKey
InChIKey=BOAJQNGPTSVJPD-UHFFFAOYSA-N
Formula
C24H28ClN3O3
Mass
441.96
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
3-halobenzoic acids and derivatives Benzomorpholines Anisoles Benzylamines Dialkylarylamines Methoxybenzenes Phenoxy compounds Phenylmethylamines Quinuclidines Alkyl aryl ethers Aralkylamines Aryl chlorides Piperidines Trialkylamines Amino acids and derivatives Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzomorpholine - Benzoxazine - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Anisole - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Quinuclidine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Oxazinane - Piperidine - Aryl chloride - Aryl halide - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Oxacycle - Azacycle - Ether - Carboxylic acid derivative - Organooxygen compound - Organohalogen compound - Amine - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Organic nitrogen compound - Organonitrogen compound - Organic oxide - 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