N-[(2-methoxyphenyl)methyl]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-[(2-methoxyphenyl)methyl]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)acetamide CAS Name: N-[(2-methoxyphenyl)methyl]-2-[4-(1-piperidin-1-iumyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)acetamide Traditional Name: N-o-anisyl-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)acetamide Formula: C20H33N3O2+2 MolecularWeight: 347.49492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C[NH+]2CCC(CC2)[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C[NH+]2CCC(CC2)[NH+]3CCCCC3

InChI

InChI=1S/C20H31N3O2/c1-25-19-8-4-3-7-17(19)15-21-20(24)16-22-13-9-18(10-14-22)23-11-5-2-6-12-23/h3-4,7-8,18H,2,5-6,9-16H2,1H3,(H,21,24)/p+2