Compound Identification
SMILES
CC(C)=O.CN1C2=C(C=C(Cl)C=C2)C(NC(CC2=CC3=CC=CC=C3C=C2)C1=O)=C1C=CC(=O)C=C1
InChIKey
InChIKey=OTCNIMQKVMAJPW-UHFFFAOYSA-N
Formula
C30H27ClN2O3
Mass
499.01
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
Naphthalenes Alpha amino acids and derivatives P-quinomethanes Aralkylamines Aryl chlorides Tertiary carboxylic acid amides Tertiary amines Lactams Enamines Dialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Naphthalene - P-quinomethane - Quinomethane - Aralkylamine - Aryl chloride - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Cyclic ketone - Tertiary amine - Enamine - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - 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