N-[(4-methoxyphenyl)methyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-N-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[(4-methoxyphenyl)methyl]-1-[(4-phenylmethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-benzoxybenzyl)-N-p-anisyl-piperidin-1-ium-4-carboxamide Formula: C28H33N2O3+ MolecularWeight: 445.57322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H32N2O3/c1-32-26-11-7-22(8-12-26)19-29-28(31)25-15-17-30(18-16-25)20-23-9-13-27(14-10-23)33-21-24-5-3-2-4-6-24/h2-14,25H,15-21H2,1H3,(H,29,31)/p+1