4-[6-cyano-3,5-bis(oxidanylidene)-1,2,4-triazin-2-yl]benzoic acid

Systemtic Name: 4-[6-cyano-3,5-bis(oxidanylidene)-1,2,4-triazin-2-yl]benzoic acid Openeye Name: 4-(6-cyano-3,5-dioxo-1,2,4-triazin-2-yl)benzoic acid CAS Name: 4-(6-cyano-3,5-dioxo-1,2,4-triazin-2-yl)benzoic acid IUPAC Name: 4-(6-cyano-3,5-dioxo-1,2,4-triazin-2-yl)benzoic acid Traditional Name: 4-(6-cyano-3,5-diketo-1,2,4-triazin-2-yl)benzoic acid Formula: C11H6N4O4 MolecularWeight: 258.18974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2C(=O)NC(=O)C(=N2)C#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2C(=O)NC(=O)C(=N2)C#N

InChI

InChI=1S/C11H6N4O4/c12-5-8-9(16)13-11(19)15(14-8)7-3-1-6(2-4-7)10(17)18/h1-4H,(H,17,18)(H,13,16,19)