4-(4-chlorophenyl)carbonyl-1-[2-(1-cyclohexylpiperidin-4-yl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 4-(4-chlorophenyl)carbonyl-1-[2-(1-cyclohexylpiperidin-4-yl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one Openeye Name: 4-(4-chlorobenzoyl)-1-[2-(1-cyclohexyl-4-piperidyl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-1-[2-(1-cyclohexyl-4-piperidinyl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 4-(4-chlorobenzoyl)-1-[2-(1-cyclohexylpiperidin-4-yl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one Traditional Name: 4-(4-chlorobenzoyl)-1-[2-(1-cyclohexyl-4-piperidyl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one Formula: C29H36ClN3O2 MolecularWeight: 494.06804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCC(CC2)CCN3C(=O)CN(CC4=CC=CC=C43)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCC(CC1)N2CCC(CC2)CCN3C(=O)CN(CC4=CC=CC=C43)C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H36ClN3O2/c30-25-12-10-23(11-13-25)29(35)32-20-24-6-4-5-9-27(24)33(28(34)21-32)19-16-22-14-17-31(18-15-22)26-7-2-1-3-8-26/h4-6,9-13,22,26H,1-3,7-8,14-21H2