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

Systemtic Name: (2S)-N-(2-methoxyphenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(2-methoxyphenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(2-methoxyphenyl)-2-(4-phenethyl-1-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(2-methoxyphenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(2-methoxyphenyl)-2-(4-phenethylpiperidin-1-ium-1-yl)propionamide Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1OC)[NH+]2CCC(CC2)CCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1OC)[NH+]2CCC(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O2/c1-18(23(26)24-21-10-6-7-11-22(21)27-2)25-16-14-20(15-17-25)13-12-19-8-4-3-5-9-19/h3-11,18,20H,12-17H2,1-2H3,(H,24,26)/p+1/t18-/m0/s1