1-[4-[1-cyclopentylcarbonyl-6-(3-methylphenyl)piperidin-3-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[1-cyclopentylcarbonyl-6-(3-methylphenyl)piperidin-3-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[1-(cyclopentanecarbonyl)-6-(m-tolyl)piperidine-3-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[1-[cyclopentyl(oxo)methyl]-6-(3-methylphenyl)-3-piperidinyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[1-(cyclopentanecarbonyl)-6-(3-methylphenyl)piperidine-3-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[1-(cyclopentanecarbonyl)-6-(m-tolyl)nipecotoyl]piperazino]ethanone Formula: C25H35N3O3 MolecularWeight: 425.5637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCC(CN2C(=O)C3CCCC3)C(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C2CCC(CN2C(=O)C3CCCC3)C(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C25H35N3O3/c1-18-6-5-9-21(16-18)23-11-10-22(17-28(23)25(31)20-7-3-4-8-20)24(30)27-14-12-26(13-15-27)19(2)29/h5-6,9,16,20,22-23H,3-4,7-8,10-15,17H2,1-2H3