2-(4-acetamidophenyl)-N-[[4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]phenyl]methyl]ethanamide

Systemtic Name: 2-(4-acetamidophenyl)-N-[[4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]phenyl]methyl]ethanamide Openeye Name: 2-(4-acetamidophenyl)-N-[[4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]phenyl]methyl]acetamide CAS Name: 2-(4-acetamidophenyl)-N-[[4-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]phenyl]methyl]acetamide IUPAC Name: 2-(4-acetamidophenyl)-N-[[4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]phenyl]methyl]acetamide Traditional Name: 2-(4-acetamidophenyl)-N-[4-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]benzyl]acetamide Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=CC=C(C=C2)CNC(=O)CC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=CC=C(C=C2)CNC(=O)CC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C24H31N3O2/c1-18-5-3-4-14-27(18)17-22-8-6-21(7-9-22)16-25-24(29)15-20-10-12-23(13-11-20)26-19(2)28/h6-13,18H,3-5,14-17H2,1-2H3,(H,25,29)(H,26,28)/p+1/t18-/m0/s1