4-chloranyl-3-[(6-fluoranyl-1H-1,2,3-triazin-2-yl)amino]benzenesulfonic acid

Systemtic Name: 4-chloranyl-3-[(6-fluoranyl-1H-1,2,3-triazin-2-yl)amino]benzenesulfonic acid Openeye Name: 4-chloro-3-[(6-fluoro-1H-triazin-2-yl)amino]benzenesulfonic acid CAS Name: 4-chloro-3-[(6-fluoro-1H-triazin-2-yl)amino]benzenesulfonic acid IUPAC Name: 4-chloro-3-[(6-fluoro-1H-triazin-2-yl)amino]benzenesulfonic acid Traditional Name: 4-chloro-3-[(6-fluoro-1H-triazin-2-yl)amino]besylic acid Formula: C9H8ClFN4O3S MolecularWeight: 306.701223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8ClFN4O3S/c10-7-2-1-6(19(16,17)18)5-8(7)13-15-12-4-3-9(11)14-15/h1-5,13-14H,(H,16,17,18)