2-cyclopentyl-1-[(3S)-3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]ethanone

Systemtic Name: 2-cyclopentyl-1-[(3S)-3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]ethanone Openeye Name: 2-cyclopentyl-1-[(3S)-3-[4-(o-tolyl)piperazin-1-ium-1-yl]-1-piperidyl]ethanone CAS Name: 2-cyclopentyl-1-[(3S)-3-[4-(2-methylphenyl)-1-piperazin-1-iumyl]-1-piperidinyl]ethanone IUPAC Name: 2-cyclopentyl-1-[(3S)-3-[4-(2-methylphenyl)piperazin-1-ium-1-yl]piperidin-1-yl]ethanone Traditional Name: 2-cyclopentyl-1-[(3S)-3-[4-(o-tolyl)piperazin-1-ium-1-yl]piperidino]ethanone Formula: C23H36N3O+ MolecularWeight: 370.55144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)C3CCCN(C3)C(=O)CC4CCCC4

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)[C@H]3CCCN(C3)C(=O)CC4CCCC4

InChI

InChI=1S/C23H35N3O/c1-19-7-2-5-11-22(19)25-15-13-24(14-16-25)21-10-6-12-26(18-21)23(27)17-20-8-3-4-9-20/h2,5,7,11,20-21H,3-4,6,8-10,12-18H2,1H3/p+1/t21-/m0/s1