8-chloranyl-5-methyl-11-(3-pyrrolidin-1-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 8-chloranyl-5-methyl-11-(3-pyrrolidin-1-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one Openeye Name: 8-chloro-5-methyl-11-(3-pyrrolidin-1-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one CAS Name: 8-chloro-5-methyl-11-[1-oxo-3-(1-pyrrolidinyl)propyl]-6-benzo[b][1,4]benzodiazepinone IUPAC Name: 8-chloro-5-methyl-11-(3-pyrrolidin-1-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one Traditional Name: 8-chloro-5-methyl-11-(3-pyrrolidinopropanoyl)benzo[b][1,4]benzodiazepin-6-one Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C3=C(C1=O)C=C(C=C3)Cl)C(=O)CCN4CCCC4

Isomeric SMILES

CN1C2=CC=CC=C2N(C3=C(C1=O)C=C(C=C3)Cl)C(=O)CCN4CCCC4

InChI

InChI=1S/C21H22ClN3O2/c1-23-18-6-2-3-7-19(18)25(20(26)10-13-24-11-4-5-12-24)17-9-8-15(22)14-16(17)21(23)27/h2-3,6-9,14H,4-5,10-13H2,1H3