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

Systemtic Name: 4-(4-chlorophenyl)carbonyl-1-[(1-cyclohexylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Openeye Name: 4-(4-chlorobenzoyl)-1-[(1-cyclohexyl-4-piperidyl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-1-[(1-cyclohexyl-4-piperidinyl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 4-(4-chlorobenzoyl)-1-[(1-cyclohexylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Traditional Name: 4-(4-chlorobenzoyl)-1-[(1-cyclohexyl-4-piperidyl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Formula: C28H34ClN3O2 MolecularWeight: 480.04146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCC(CC2)CN3C(=O)CN(CC4=CC=CC=C43)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCC(CC1)N2CCC(CC2)CN3C(=O)CN(CC4=CC=CC=C43)C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H34ClN3O2/c29-24-12-10-22(11-13-24)28(34)31-19-23-6-4-5-9-26(23)32(27(33)20-31)18-21-14-16-30(17-15-21)25-7-2-1-3-8-25/h4-6,9-13,21,25H,1-3,7-8,14-20H2