N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-benzyl-N-homoveratryl-N-methyl-piperidin-1-ium-4-carboxamide Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O3/c1-25(14-11-19-9-10-22(28-2)23(17-19)29-3)24(27)21-12-15-26(16-13-21)18-20-7-5-4-6-8-20/h4-10,17,21H,11-16,18H2,1-3H3/p+1