(4-methylpiperidin-1-yl)-[1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: (4-methylpiperidin-1-yl)-[1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: (4-methyl-1-piperidyl)-[1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone CAS Name: (4-methyl-1-piperidinyl)-[1-[(3,4,5-trimethoxyphenyl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: (4-methylpiperidin-1-yl)-[1-[(3,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: (4-methylpiperidino)-[1-(3,4,5-trimethoxybenzyl)piperidin-1-ium-4-yl]methanone Formula: C22H35N2O4+ MolecularWeight: 391.5243

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2CC[NH+](CC2)CC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1CCN(CC1)C(=O)C2CC[NH+](CC2)CC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H34N2O4/c1-16-5-11-24(12-6-16)22(25)18-7-9-23(10-8-18)15-17-13-19(26-2)21(28-4)20(14-17)27-3/h13-14,16,18H,5-12,15H2,1-4H3/p+1