2-[(6-fluoranyl-1H-1,2,3-triazin-2-yl)amino]-5-sulfo-benzoic acid

Systemtic Name: 2-[(6-fluoranyl-1H-1,2,3-triazin-2-yl)amino]-5-sulfo-benzoic acid Openeye Name: 2-[(6-fluoro-1H-triazin-2-yl)amino]-5-sulfo-benzoic acid CAS Name: 2-[(6-fluoro-1H-triazin-2-yl)amino]-5-sulfobenzoic acid IUPAC Name: 2-[(6-fluoro-1H-triazin-2-yl)amino]-5-sulfobenzoic acid Traditional Name: 2-[(6-fluoro-1H-triazin-2-yl)amino]-5-sulfo-benzoic acid Formula: C10H9FN4O5S MolecularWeight: 316.265663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)NN2NC(=CC=N2)F

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)NN2NC(=CC=N2)F

InChI

InChI=1S/C10H9FN4O5S/c11-9-3-4-12-15(14-9)13-8-2-1-6(21(18,19)20)5-7(8)10(16)17/h1-5,13-14H,(H,16,17)(H,18,19,20)