Compound Identification
SMILES
CCOC(=O)N1CCC(CC1)=C1C2=C(OCC3=C1N=CC=C3)C(=CC=C2)[N+]([O-])=O
InChIKey
InChIKey=SXERIPBAXSKSOT-UHFFFAOYSA-N
Formula
C21H21N3O5
Mass
395.415
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxepines
Alternative Parents
Piperidinecarboxylic acids Nitroaromatic compounds Alkyl aryl ethers Pyridines and derivatives Benzenoids Carbamate esters Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxepine - Piperidinecarboxylic acid - Nitroaromatic compound - Alkyl aryl ether - Piperidine - Pyridine - Benzenoid - Heteroaromatic compound - Carbamic acid ester - C-nitro compound - Organic nitro compound - Ether - Organic oxoazanium - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic salt - Organic nitrogen compound - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxepines. These are organic compounds containing a benzene ring fused to an oxepine ring (an unsaturated seven-membered heterocycle with one oxygen atom replacing a carbon atom).
External Descriptors
Not available