[(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-prop-2-ynyl-azanium

Systemtic Name: [(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-prop-2-ynyl-azanium Openeye Name: [(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl]-prop-2-ynyl-ammonium CAS Name: [(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]-prop-2-ynylammonium IUPAC Name: [(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]-prop-2-ynylazanium Traditional Name: [(1S)-2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl]-propargyl-ammonium Formula: C13H16N3O2+ MolecularWeight: 246.28504

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)[NH2+]CC#C

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)[NH2+]CC#C

InChI

InChI=1S/C13H15N3O2/c1-3-9-15-11(10-7-5-4-6-8-10)12(17)16-13(18)14-2/h1,4-8,11,15H,9H2,2H3,(H2,14,16,17,18)/p+1/t11-/m0/s1