N-[(2S)-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-piperidin-1-ium-1-yl-ethyl]-N'-(4-methylphenyl)ethanediamide

Systemtic Name: N-[(2S)-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-piperidin-1-ium-1-yl-ethyl]-N'-(4-methylphenyl)ethanediamide Openeye Name: N-[(2S)-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-piperidin-1-ium-1-yl-ethyl]-N'-(p-tolyl)oxamide CAS Name: N-[(2S)-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(1-piperidin-1-iumyl)ethyl]-N'-(4-methylphenyl)oxamide IUPAC Name: N-[(2S)-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-piperidin-1-ium-1-ylethyl]-N'-(4-methylphenyl)oxamide Traditional Name: N-[(2S)-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-piperidin-1-ium-1-yl-ethyl]-N'-(p-tolyl)oxamide Formula: C26H35N4O2+ MolecularWeight: 435.5817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=O)NCC(C2=CC3=C(C=C2)N(CCC3)C)[NH+]4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(=O)NC[C@H](C2=CC3=C(C=C2)N(CCC3)C)[NH+]4CCCCC4

InChI

InChI=1S/C26H34N4O2/c1-19-8-11-22(12-9-19)28-26(32)25(31)27-18-24(30-15-4-3-5-16-30)21-10-13-23-20(17-21)7-6-14-29(23)2/h8-13,17,24H,3-7,14-16,18H2,1-2H3,(H,27,31)(H,28,32)/p+1/t24-/m1/s1