3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-(3-methylphenyl)propanamide

Systemtic Name: 3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-(3-methylphenyl)propanamide Openeye Name: 3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-(m-tolyl)propanamide CAS Name: 3-[1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-piperidin-1-iumyl]-N-(3-methylphenyl)propanamide IUPAC Name: 3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-(3-methylphenyl)propanamide Traditional Name: 3-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-(m-tolyl)propionamide Formula: C22H33N2O+ MolecularWeight: 341.51022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCC2CC[NH+](CC2)CC3CCC=CC3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCC2CC[NH+](CC2)C[C@H]3CCC=CC3

InChI

InChI=1S/C22H32N2O/c1-18-6-5-9-21(16-18)23-22(25)11-10-19-12-14-24(15-13-19)17-20-7-3-2-4-8-20/h2-3,5-6,9,16,19-20H,4,7-8,10-15,17H2,1H3,(H,23,25)/p+1/t20-/m1/s1