Compound Identification
SMILES
OCC1CN2CC(=O)NC3=C(C=C(Cl)C=C3)C2(O1)C1=CC=CC=C1
InChIKey
InChIKey=LSNCVFADIIAYNQ-UHFFFAOYSA-N
Formula
C18H17ClN2O3
Mass
344.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
-
Subclass
1,4-benzodiazepines
- Level 5 1,3-oxazolobenzo-1,4-diazepines
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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
1,3-oxazolobenzo-1,4-diazepines
Alternative Parents
Alpha amino acids and derivatives Benzene and substituted derivatives Aryl chlorides Oxazolidines Secondary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Primary alcohols Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-oxazolobenzo-1,4-diazepine - Alpha-amino acid or derivatives - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Oxazolidine - Carboxamide group - Lactam - Secondary carboxylic acid amide - Oxacycle - Carboxylic acid derivative - Azacycle - Organochloride - Organohalogen compound - Amine - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-oxazolobenzo-1,4-diazepines. These are aromatic heteropolycyclic compounds containing a 1,3-oxazole ring fused to the 1,-4-diazepine moiety of a 1,4-benzodiazepine ring system.
External Descriptors
Not available