1-[(2-chlorophenyl)methyl]-5-[[1-(phenylmethyl)piperidin-4-yl]amino]azepan-2-one

Systemtic Name: 1-[(2-chlorophenyl)methyl]-5-[[1-(phenylmethyl)piperidin-4-yl]amino]azepan-2-one Openeye Name: 5-[(1-benzyl-4-piperidyl)amino]-1-[(2-chlorophenyl)methyl]azepan-2-one CAS Name: 1-[(2-chlorophenyl)methyl]-5-[[1-(phenylmethyl)-4-piperidinyl]amino]-2-azepanone IUPAC Name: 5-[(1-benzylpiperidin-4-yl)amino]-1-[(2-chlorophenyl)methyl]azepan-2-one Traditional Name: 5-[(1-benzyl-4-piperidyl)amino]-1-(2-chlorobenzyl)azepan-2-one Formula: C25H32ClN3O MolecularWeight: 425.99408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CCC1NC2CCN(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4Cl

Isomeric SMILES

C1CC(=O)N(CCC1NC2CCN(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C25H32ClN3O/c26-24-9-5-4-8-21(24)19-29-17-14-22(10-11-25(29)30)27-23-12-15-28(16-13-23)18-20-6-2-1-3-7-20/h1-9,22-23,27H,10-19H2