(2S)-1-[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl]-N-phenyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl]-N-phenyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[2-(methylcarbamoylamino)-2-oxo-ethyl]-N-phenyl-pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[2-(methylcarbamoylamino)-2-oxoethyl]-N-phenyl-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[2-(methylcarbamoylamino)-2-oxoethyl]-N-phenylpyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-[2-keto-2-(methylcarbamoylamino)ethyl]-N-phenyl-pyrrolidin-1-ium-2-carboxamide Formula: C15H21N4O3+ MolecularWeight: 305.35224

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C[NH+]1CCCC1C(=O)NC2=CC=CC=C2

Isomeric SMILES

CNC(=O)NC(=O)C[NH+]1CCC[C@H]1C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C15H20N4O3/c1-16-15(22)18-13(20)10-19-9-5-8-12(19)14(21)17-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3,(H,17,21)(H2,16,18,20,22)/p+1/t12-/m0/s1