(2,6-dimethylphenyl)-[4-[4-[phenyl(pyridin-3-ylmethyl)amino]piperidin-1-yl]piperidin-1-yl]methanone

Systemtic Name: (2,6-dimethylphenyl)-[4-[4-[phenyl(pyridin-3-ylmethyl)amino]piperidin-1-yl]piperidin-1-yl]methanone Openeye Name: (2,6-dimethylphenyl)-[4-[4-[N-(3-pyridylmethyl)anilino]-1-piperidyl]-1-piperidyl]methanone CAS Name: (2,6-dimethylphenyl)-[4-[4-[N-(3-pyridinylmethyl)anilino]-1-piperidinyl]-1-piperidinyl]methanone IUPAC Name: (2,6-dimethylphenyl)-[4-[4-[N-(pyridin-3-ylmethyl)anilino]piperidin-1-yl]piperidin-1-yl]methanone Traditional Name: (2,6-dimethylphenyl)-[4-[4-[N-(3-pyridylmethyl)anilino]piperidino]piperidino]methanone Formula: C31H38N4O MolecularWeight: 482.65962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)N2CCC(CC2)N3CCC(CC3)N(CC4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)N2CCC(CC2)N3CCC(CC3)N(CC4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H38N4O/c1-24-8-6-9-25(2)30(24)31(36)34-20-13-27(14-21-34)33-18-15-29(16-19-33)35(28-11-4-3-5-12-28)23-26-10-7-17-32-22-26/h3-12,17,22,27,29H,13-16,18-21,23H2,1-2H3