(2S)-N-(4-methylphenyl)-2-morpholin-4-ium-4-yl-propanamide

Systemtic Name: (2S)-N-(4-methylphenyl)-2-morpholin-4-ium-4-yl-propanamide Openeye Name: (2S)-2-morpholin-4-ium-4-yl-N-(p-tolyl)propanamide CAS Name: (2S)-N-(4-methylphenyl)-2-(4-morpholin-4-iumyl)propanamide IUPAC Name: (2S)-N-(4-methylphenyl)-2-morpholin-4-ium-4-ylpropanamide Traditional Name: (2S)-2-morpholin-4-ium-4-yl-N-(p-tolyl)propionamide Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)[NH+]2CCOCC2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C)[NH+]2CCOCC2

InChI

InChI=1S/C14H20N2O2/c1-11-3-5-13(6-4-11)15-14(17)12(2)16-7-9-18-10-8-16/h3-6,12H,7-10H2,1-2H3,(H,15,17)/p+1/t12-/m0/s1