(phenylmethyl) (2S)-2-(cyanocarbamoyl)-5-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-(cyanocarbamoyl)-5-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-(cyanocarbamoyl)-5-oxo-pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(cyanoamino)-oxomethyl]-5-oxo-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(cyanocarbamoyl)-5-oxopyrrolidine-1-carboxylate Traditional Name: (2S)-2-(cyanocarbamoyl)-5-keto-pyrrolidine-1-carboxylic acid benzyl ester Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C(=O)NC#N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC(=O)N([C@@H]1C(=O)NC#N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H13N3O4/c15-9-16-13(19)11-6-7-12(18)17(11)14(20)21-8-10-4-2-1-3-5-10/h1-5,11H,6-8H2,(H,16,19)/t11-/m0/s1