(2S)-2-(cyanomethanimidoyl)-3-oxidanylidene-N-phenyl-butanamide

Systemtic Name: (2S)-2-(cyanomethanimidoyl)-3-oxidanylidene-N-phenyl-butanamide Openeye Name: (2S)-3-oxo-2-(phenylcarbamoyl)butanimidoyl cyanide CAS Name: (2S)-2-[cyano(imino)methyl]-3-oxo-N-phenylbutanamide IUPAC Name: (2S)-3-oxo-2-(phenylcarbamoyl)butanimidoyl cyanide Traditional Name: (2S)-2-(cyanoformimidoyl)-3-keto-N-phenyl-butyramide Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=N)C#N)C(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(=O)[C@H](C(=N)C#N)C(=O)NC1=CC=CC=C1

InChI

InChI=1S/C12H11N3O2/c1-8(16)11(10(14)7-13)12(17)15-9-5-3-2-4-6-9/h2-6,11,14H,1H3,(H,15,17)/t11-/m1/s1