5-methyl-11-(3-morpholin-4-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one hydrochloride

Systemtic Name: 5-methyl-11-(3-morpholin-4-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one hydrochloride Openeye Name: 5-methyl-11-(3-morpholinopropanoyl)benzo[b][1,4]benzodiazepin-6-one hydrochloride CAS Name: 5-methyl-11-[3-(4-morpholinyl)-1-oxopropyl]-6-benzo[b][1,4]benzodiazepinone hydrochloride IUPAC Name: 5-methyl-11-(3-morpholin-4-ylpropanoyl)benzo[b][1,4]benzodiazepin-6-one hydrochloride Traditional Name: 5-methyl-11-(3-morpholinopropanoyl)benzo[b][1,4]benzodiazepin-6-one hydrochloride Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C3=CC=CC=C3C1=O)C(=O)CCN4CCOCC4.Cl

Isomeric SMILES

CN1C2=CC=CC=C2N(C3=CC=CC=C3C1=O)C(=O)CCN4CCOCC4.Cl

InChI

InChI=1S/C21H23N3O3.ClH/c1-22-18-8-4-5-9-19(18)24(17-7-3-2-6-16(17)21(22)26)20(25)10-11-23-12-14-27-15-13-23;/h2-9H,10-15H2,1H3;1H