methyl 2-(3-cyano-5-oxidanylidene-1,2,4-oxadiazin-4-yl)benzoate

Systemtic Name: methyl 2-(3-cyano-5-oxidanylidene-1,2,4-oxadiazin-4-yl)benzoate Openeye Name: methyl 2-(3-cyano-5-oxo-1,2,4-oxadiazin-4-yl)benzoate CAS Name: 2-(3-cyano-5-oxo-1,2,4-oxadiazin-4-yl)benzoic acid methyl ester IUPAC Name: methyl 2-(3-cyano-5-oxo-1,2,4-oxadiazin-4-yl)benzoate Traditional Name: 2-(3-cyano-5-keto-1,2,4-oxadiazin-4-yl)benzoic acid methyl ester Formula: C12H9N3O4 MolecularWeight: 259.21756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2C(=O)CON=C2C#N

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2C(=O)CON=C2C#N

InChI

InChI=1S/C12H9N3O4/c1-18-12(17)8-4-2-3-5-9(8)15-10(6-13)14-19-7-11(15)16/h2-5H,7H2,1H3