N-[(4-methylphenyl)methyl]-1-[(2,3,4-trimethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1-[(2,3,4-trimethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(p-tolylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-1-[(2,3,4-trimethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-1-[(2,3,4-trimethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(4-methylbenzyl)-1-(2,3,4-trimethoxybenzyl)piperidin-1-ium-4-carboxamide Formula: C24H33N2O4+ MolecularWeight: 413.52982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=C(C(=C(C=C3)OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=C(C(=C(C=C3)OC)OC)OC

InChI

InChI=1S/C24H32N2O4/c1-17-5-7-18(8-6-17)15-25-24(27)19-11-13-26(14-12-19)16-20-9-10-21(28-2)23(30-4)22(20)29-3/h5-10,19H,11-16H2,1-4H3,(H,25,27)/p+1