N-(4-methylphenyl)-2-[4-[(S)-oxidanyl(phenyl)methyl]piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-[(S)-oxidanyl(phenyl)methyl]piperidin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[(S)-hydroxy(phenyl)methyl]piperidin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[(S)-hydroxy(phenyl)methyl]-1-piperidin-1-iumyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-[(S)-hydroxy(phenyl)methyl]piperidin-1-ium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-[(S)-hydroxy(phenyl)methyl]piperidin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCC(CC2)C(C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCC(CC2)[C@@H](C3=CC=CC=C3)O

InChI

InChI=1S/C21H26N2O2/c1-16-7-9-19(10-8-16)22-20(24)15-23-13-11-18(12-14-23)21(25)17-5-3-2-4-6-17/h2-10,18,21,25H,11-15H2,1H3,(H,22,24)/p+1/t21-/m1/s1