2-[(2-cyano-3-pyrrolidin-1-yl-phenyl)amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[(2-cyano-3-pyrrolidin-1-yl-phenyl)amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(2-cyano-3-pyrrolidin-1-yl-anilino)-2-oxo-acetic acid CAS Name: 2-[2-cyano-3-(1-pyrrolidinyl)anilino]-2-oxoacetic acid IUPAC Name: 2-(2-cyano-3-pyrrolidin-1-ylanilino)-2-oxoacetic acid Traditional Name: 2-(2-cyano-3-pyrrolidino-anilino)-2-keto-acetic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=CC=C2)NC(=O)C(=O)O)C#N

Isomeric SMILES

C1CCN(C1)C2=C(C(=CC=C2)NC(=O)C(=O)O)C#N

InChI

InChI=1S/C13H13N3O3/c14-8-9-10(15-12(17)13(18)19)4-3-5-11(9)16-6-1-2-7-16/h3-5H,1-2,6-7H2,(H,15,17)(H,18,19)