Compound Identification
SMILES
CC(C)(C)OC(=O)NC1=C(C=CC=N1)[C@@H]1C(=O)N(CCCCO)C2=CC=CC=C2C[N+]1=O
InChIKey
InChIKey=KPXHJOAAKUDJJG-LJQANCHMSA-O
Formula
C23H29N4O5
Mass
441.507
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Alpha amino acids and derivatives Pyridines and derivatives Imidolactams Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Carbamate esters Lactams Alkanolamines Organic oxoazanium compounds Aminoxides Azacyclic compounds Primary alcohols Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Pyridine - Benzenoid - Imidolactam - Tertiary carboxylic acid amide - Carbamic acid ester - Heteroaromatic compound - Carboxamide group - Lactam - Azacycle - Aminoxide - Alkanolamine - Carboxylic acid derivative - Organic oxoazanium - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Primary alcohol - Organic oxygen compound - Alcohol - Carbonyl group - Organic oxide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.
External Descriptors
Not available