(2S)-N-(2-methylphenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-(2-methylphenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]propanamide Openeye Name: (2S)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(o-tolyl)propanamide CAS Name: (2S)-N-(2-methylphenyl)-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(2-methylphenyl)propanamide Traditional Name: (2S)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(o-tolyl)propionamide Formula: C22H29N2O+ MolecularWeight: 337.47846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](C)[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O/c1-17-8-6-7-11-21(17)23-22(25)18(2)24-14-12-20(13-15-24)16-19-9-4-3-5-10-19/h3-11,18,20H,12-16H2,1-2H3,(H,23,25)/p+1/t18-/m0/s1