Compound Identification
SMILES
COC(=O)C(C)C1=CC=C(NC2=NC3=C(OC2)C=CC(=C3)[N+]([O-])=O)C=C1
InChIKey
InChIKey=GXJUUFQOJFFNBL-UHFFFAOYSA-N
Formula
C18H17N3O5
Mass
355.35
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
Aniline and substituted anilines Nitroaromatic compounds Alkyl aryl ethers Imidolactams Methyl esters Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Carboxamidines Monocarboxylic acids and derivatives Organic oxoazanium compounds Organopnictogen compounds Organic salts Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazine - Nitroaromatic compound - Aniline or substituted anilines - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Imidolactam - Methyl ester - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Oxacycle - Carboxylic acid amidine - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxoazanium - Amidine - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - 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