1-[(3,5-dimethoxyphenyl)methyl]-N-(2-hydroxyethyl)-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3,5-dimethoxyphenyl)methyl]-N-(2-hydroxyethyl)-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[(3,5-dimethoxyphenyl)methyl]-N-(2-hydroxyethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(3,5-dimethoxyphenyl)methyl]-N-(2-hydroxyethyl)-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[(3,5-dimethoxyphenyl)methyl]-N-(2-hydroxyethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-(3,5-dimethoxybenzyl)-N-(2-hydroxyethyl)piperidin-1-ium-4-carboxamide Formula: C24H33N2O4+ MolecularWeight: 413.52982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[NH+]2CCC(CC2)C(=O)N(CCO)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[NH+]2CCC(CC2)C(=O)N(CCO)CC3=CC=CC=C3)OC

InChI

InChI=1S/C24H32N2O4/c1-29-22-14-20(15-23(16-22)30-2)17-25-10-8-21(9-11-25)24(28)26(12-13-27)18-19-6-4-3-5-7-19/h3-7,14-16,21,27H,8-13,17-18H2,1-2H3/p+1