(2S)-N-(4-acetamidophenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(4-acetamidophenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(4-acetamidophenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(4-acetamidophenyl)-2-(4-phenethyl-1-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(4-acetamidophenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(4-acetamidophenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propionamide Formula: C24H32N3O2+ MolecularWeight: 394.52978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)[NH+]2CCC(CC2)CCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)NC(=O)C)[NH+]2CCC(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O2/c1-18(24(29)26-23-12-10-22(11-13-23)25-19(2)28)27-16-14-21(15-17-27)9-8-20-6-4-3-5-7-20/h3-7,10-13,18,21H,8-9,14-17H2,1-2H3,(H,25,28)(H,26,29)/p+1/t18-/m0/s1