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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(2-hydroxyphenyl)methyl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(2-hydroxyphenyl)methyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(2-hydroxyphenyl)methyl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(2-hydroxyphenyl)methyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: N-homoveratryl-N-methyl-1-salicyl-piperidin-1-ium-4-carboxamide Formula: C24H33N2O4+ MolecularWeight: 413.52982

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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=C3O

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2CC[NH+](CC2)CC3=CC=CC=C3O

InChI

InChI=1S/C24H32N2O4/c1-25(13-10-18-8-9-22(29-2)23(16-18)30-3)24(28)19-11-14-26(15-12-19)17-20-6-4-5-7-21(20)27/h4-9,16,19,27H,10-15,17H2,1-3H3/p+1