3-[(3E)-3-(5-cyano-3-oxidanylidene-pyridin-2-ylidene)-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[(3E)-3-(5-cyano-3-oxidanylidene-pyridin-2-ylidene)-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[(3E)-3-(5-cyano-3-oxo-2-pyridylidene)-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[(3E)-3-(5-cyano-3-oxo-2-pyridinylidene)-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[(3E)-3-(5-cyano-3-oxopyridin-2-ylidene)-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[(3E)-3-(5-cyano-3-keto-2-pyridylidene)-1,2,4-oxadiazol-5-yl]propionic acid Formula: C11H8N4O4 MolecularWeight: 260.20562

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C2NOC(=N2)CCC(=O)O)C1=O)C#N

Isomeric SMILES

C1=C(C=N/C(=C\2/NOC(=N2)CCC(=O)O)/C1=O)C#N

InChI

InChI=1S/C11H8N4O4/c12-4-6-3-7(16)10(13-5-6)11-14-8(19-15-11)1-2-9(17)18/h3,5,15H,1-2H2,(H,17,18)/b11-10+