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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(naphthalen-1-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(1-naphthylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(1-naphthalenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(naphthalen-1-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-homoveratryl-N-methyl-1-(1-naphthylmethyl)piperidin-1-ium-4-carboxamide Formula: C28H35N2O3+ MolecularWeight: 447.5891

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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=CC4=CC=CC=C43

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H34N2O3/c1-29(16-13-21-11-12-26(32-2)27(19-21)33-3)28(31)23-14-17-30(18-15-23)20-24-9-6-8-22-7-4-5-10-25(22)24/h4-12,19,23H,13-18,20H2,1-3H3/p+1