2-(2-fluoranyl-4-propan-2-yloxy-phenyl)-3,5-bis(oxidanylidene)-1,2,4-triazine-6-carboxylic acid

Systemtic Name: 2-(2-fluoranyl-4-propan-2-yloxy-phenyl)-3,5-bis(oxidanylidene)-1,2,4-triazine-6-carboxylic acid Openeye Name: 2-(2-fluoro-4-isopropoxy-phenyl)-3,5-dioxo-1,2,4-triazine-6-carboxylic acid CAS Name: 2-(2-fluoro-4-propan-2-yloxyphenyl)-3,5-dioxo-1,2,4-triazine-6-carboxylic acid IUPAC Name: 2-(2-fluoro-4-propan-2-yloxyphenyl)-3,5-dioxo-1,2,4-triazine-6-carboxylic acid Traditional Name: 2-(2-fluoro-4-isopropoxy-phenyl)-3,5-diketo-1,2,4-triazine-6-carboxylic acid Formula: C13H12FN3O5 MolecularWeight: 309.249883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)N2C(=O)NC(=O)C(=N2)C(=O)O)F

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)N2C(=O)NC(=O)C(=N2)C(=O)O)F

InChI

InChI=1S/C13H12FN3O5/c1-6(2)22-7-3-4-9(8(14)5-7)17-13(21)15-11(18)10(16-17)12(19)20/h3-6H,1-2H3,(H,19,20)(H,15,18,21)