(2S)-N-(2-ethoxyphenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(2-ethoxyphenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(2-ethoxyphenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(2-ethoxyphenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propanamide IUPAC Name: (2S)-N-(2-ethoxyphenyl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-o-phenetyl-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)propionamide Formula: C22H27N2O2+ MolecularWeight: 351.46198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)[NH+]2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C)[NH+]2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2/c1-3-26-21-12-8-7-11-20(21)23-22(25)17(2)24-15-13-19(14-16-24)18-9-5-4-6-10-18/h4-13,17H,3,14-16H2,1-2H3,(H,23,25)/p+1/t17-/m0/s1