7-chloranyl-1-(1-methylpiperidin-4-yl)-5-phenyl-3H-1,4-benzodiazepin-2-one hydrochloride

Systemtic Name: 7-chloranyl-1-(1-methylpiperidin-4-yl)-5-phenyl-3H-1,4-benzodiazepin-2-one hydrochloride Openeye Name: 7-chloro-1-(1-methyl-4-piperidyl)-5-phenyl-3H-1,4-benzodiazepin-2-one hydrochloride CAS Name: 7-chloro-1-(1-methyl-4-piperidinyl)-5-phenyl-3H-1,4-benzodiazepin-2-one hydrochloride IUPAC Name: 7-chloro-1-(1-methylpiperidin-4-yl)-5-phenyl-3H-1,4-benzodiazepin-2-one hydrochloride Traditional Name: 7-chloro-1-(1-methyl-4-piperidyl)-5-phenyl-3H-1,4-benzodiazepin-2-one hydrochloride Formula: C21H23Cl2N3O MolecularWeight: 404.33282

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N2C(=O)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4.Cl

Isomeric SMILES

CN1CCC(CC1)N2C(=O)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4.Cl

InChI

InChI=1S/C21H22ClN3O.ClH/c1-24-11-9-17(10-12-24)25-19-8-7-16(22)13-18(19)21(23-14-20(25)26)15-5-3-2-4-6-15;/h2-8,13,17H,9-12,14H2,1H3;1H