1-[4-[3-(4-cyclohexylpiperazin-1-yl)carbonyl-6-methyl-pyridin-2-yl]piperidin-1-yl]-2-(3-methoxyphenyl)ethanone

Systemtic Name: 1-[4-[3-(4-cyclohexylpiperazin-1-yl)carbonyl-6-methyl-pyridin-2-yl]piperidin-1-yl]-2-(3-methoxyphenyl)ethanone Openeye Name: 1-[4-[3-(4-cyclohexylpiperazine-1-carbonyl)-6-methyl-2-pyridyl]-1-piperidyl]-2-(3-methoxyphenyl)ethanone CAS Name: 1-[4-[3-[(4-cyclohexyl-1-piperazinyl)-oxomethyl]-6-methyl-2-pyridinyl]-1-piperidinyl]-2-(3-methoxyphenyl)ethanone IUPAC Name: 1-[4-[3-(4-cyclohexylpiperazine-1-carbonyl)-6-methylpyridin-2-yl]piperidin-1-yl]-2-(3-methoxyphenyl)ethanone Traditional Name: 1-[4-[3-(4-cyclohexylpiperazine-1-carbonyl)-6-methyl-2-pyridyl]piperidino]-2-(3-methoxyphenyl)ethanone Formula: C31H42N4O3 MolecularWeight: 518.69018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C3CCCCC3)C4CCN(CC4)C(=O)CC5=CC(=CC=C5)OC

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C3CCCCC3)C4CCN(CC4)C(=O)CC5=CC(=CC=C5)OC

InChI

InChI=1S/C31H42N4O3/c1-23-11-12-28(31(37)35-19-17-33(18-20-35)26-8-4-3-5-9-26)30(32-23)25-13-15-34(16-14-25)29(36)22-24-7-6-10-27(21-24)38-2/h6-7,10-12,21,25-26H,3-5,8-9,13-20,22H2,1-2H3