N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-[(4S)-2-oxidanylidene-4-phenyl-pyrrolidin-1-yl]ethanamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-[(4S)-2-oxidanylidene-4-phenyl-pyrrolidin-1-yl]ethanamide Openeye Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-[(4S)-2-oxo-4-phenyl-pyrrolidin-1-yl]acetamide CAS Name: N-[[2-(dimethylamino)-3-pyridin-1-iumyl]methyl]-2-[(4S)-2-oxo-4-phenyl-1-pyrrolidinyl]acetamide IUPAC Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]acetamide Traditional Name: N-[[2-(dimethylamino)pyridin-1-ium-3-yl]methyl]-2-[(4S)-2-keto-4-phenyl-pyrrolidino]acetamide Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=[NH+]1)CNC(=O)CN2CC(CC2=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=C(C=CC=[NH+]1)CNC(=O)CN2C[C@@H](CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4O2/c1-23(2)20-16(9-6-10-21-20)12-22-18(25)14-24-13-17(11-19(24)26)15-7-4-3-5-8-15/h3-10,17H,11-14H2,1-2H3,(H,22,25)/p+1/t17-/m1/s1