4-(4-fluoranyl-1,4-dihydro-1,3,5-triazin-2-yl)benzene-1,3-disulfonic acid

Systemtic Name: 4-(4-fluoranyl-1,4-dihydro-1,3,5-triazin-2-yl)benzene-1,3-disulfonic acid Openeye Name: 4-(4-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)benzene-1,3-disulfonic acid CAS Name: 4-(4-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)benzene-1,3-disulfonic acid IUPAC Name: 4-(4-fluoro-1,4-dihydro-1,3,5-triazin-2-yl)benzene-1,3-disulfonic acid Traditional Name: 4-(4-fluoro-1,4-dihydro-s-triazin-2-yl)benzene-1,3-disulfonic acid Formula: C9H8FN3O6S2 MolecularWeight: 337.304723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)S(=O)(=O)O)C2=NC(N=CN2)F

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)S(=O)(=O)O)C2=NC(N=CN2)F

InChI

InChI=1S/C9H8FN3O6S2/c10-9-12-4-11-8(13-9)6-2-1-5(20(14,15)16)3-7(6)21(17,18)19/h1-4,9H,(H,11,12,13)(H,14,15,16)(H,17,18,19)