1-[4-[4-[2-(4-pyridin-2-ylpiperazin-1-yl)carbonylcyclohexyl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[2-(4-pyridin-2-ylpiperazin-1-yl)carbonylcyclohexyl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexanecarbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[oxo-[2-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]cyclohexyl]methyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[2-(4-pyridin-2-ylpiperazine-1-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexanecarbonyl]piperazino]phenyl]ethanone Formula: C29H37N5O3 MolecularWeight: 503.63578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCCCC3C(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCCCC3C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C29H37N5O3/c1-22(35)23-9-11-24(12-10-23)31-14-18-33(19-15-31)28(36)25-6-2-3-7-26(25)29(37)34-20-16-32(17-21-34)27-8-4-5-13-30-27/h4-5,8-13,25-26H,2-3,6-7,14-21H2,1H3