N-cyclopentyl-5-cyclopropyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-1H-pyrazole-3-carboxamide

Systemtic Name: N-cyclopentyl-5-cyclopropyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-1H-pyrazole-3-carboxamide Openeye Name: N-cyclopentyl-5-cyclopropyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]-1H-pyrazole-3-carboxamide CAS Name: N-cyclopentyl-5-cyclopropyl-N-[[1-[2-(2-methylphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-1H-pyrazole-3-carboxamide IUPAC Name: N-cyclopentyl-5-cyclopropyl-N-[[1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-1H-pyrazole-3-carboxamide Traditional Name: N-cyclopentyl-5-cyclopropyl-N-[[1-[2-(o-tolyl)ethyl]piperidin-1-ium-4-yl]methyl]-1H-pyrazole-3-carboxamide Formula: C27H39N4O+ MolecularWeight: 435.62476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC[NH+]2CCC(CC2)CN(C3CCCC3)C(=O)C4=NNC(=C4)C5CC5

Isomeric SMILES

CC1=CC=CC=C1CC[NH+]2CCC(CC2)CN(C3CCCC3)C(=O)C4=NNC(=C4)C5CC5

InChI

InChI=1S/C27H38N4O/c1-20-6-2-3-7-22(20)14-17-30-15-12-21(13-16-30)19-31(24-8-4-5-9-24)27(32)26-18-25(28-29-26)23-10-11-23/h2-3,6-7,18,21,23-24H,4-5,8-17,19H2,1H3,(H,28,29)/p+1