Compound Identification
SMILES
OC(=O)\C=C/C([O-])=O.C[NH+](C)CCOC1C2=CC=CC=C2CCC2=C1C=CC=N2
InChIKey
InChIKey=YTGPECWXLHXQEQ-BTJKTKAUSA-N
Formula
C22H26N2O5
Mass
398.459
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzocycloheptapyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzocycloheptapyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzocycloheptapyridines
Alternative Parents
Unsaturated fatty acids Pyridines and derivatives Dicarboxylic acids and derivatives Benzenoids Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Carboxylic acid salts Dialkyl ethers Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Not available
Substituents
Benzocycloheptapyridine - Dicarboxylic acid or derivatives - Pyridine - Unsaturated fatty acid - Benzenoid - Fatty acid - Fatty acyl - Quaternary ammonium salt - Heteroaromatic compound - Carboxylic acid salt - Tertiary amine - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Amine - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzocycloheptapyridines. These are aromatic compounds containing a benzene ring and a pyridine ring fused to a seven membered carbocycle.
External Descriptors
Not available