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

Systemtic Name: N-(2-methoxyphenyl)-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-(2-methoxyphenyl)-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)acetamide CAS Name: N-(2-methoxyphenyl)-2-[4-(1-piperidin-1-iumyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2-methoxyphenyl)-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)acetamide Traditional Name: N-(2-methoxyphenyl)-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)acetamide Formula: C19H31N3O2+2 MolecularWeight: 333.46834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)[NH+]3CCCCC3

InChI

InChI=1S/C19H29N3O2/c1-24-18-8-4-3-7-17(18)20-19(23)15-21-13-9-16(10-14-21)22-11-5-2-6-12-22/h3-4,7-8,16H,2,5-6,9-15H2,1H3,(H,20,23)/p+2