6,6-bis(3-fluorophenyl)-1-(4-methylphenyl)sulfonyl-7H-indazole-3-carboxylic acid

Systemtic Name: 6,6-bis(3-fluorophenyl)-1-(4-methylphenyl)sulfonyl-7H-indazole-3-carboxylic acid Openeye Name: 6,6-bis(3-fluorophenyl)-1-(p-tolylsulfonyl)-7H-indazole-3-carboxylic acid CAS Name: 6,6-bis(3-fluorophenyl)-1-(4-methylphenyl)sulfonyl-7H-indazole-3-carboxylic acid IUPAC Name: 6,6-bis(3-fluorophenyl)-1-(4-methylphenyl)sulfonyl-7H-indazole-3-carboxylic acid Traditional Name: 6,6-bis(3-fluorophenyl)-1-tosyl-7H-indazole-3-carboxylic acid Formula: C27H20F2N2O4S MolecularWeight: 506.520506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=CC(C3)(C4=CC(=CC=C4)F)C5=CC(=CC=C5)F)C(=N2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=CC(C3)(C4=CC(=CC=C4)F)C5=CC(=CC=C5)F)C(=N2)C(=O)O

InChI

InChI=1S/C27H20F2N2O4S/c1-17-8-10-22(11-9-17)36(34,35)31-24-16-27(18-4-2-6-20(28)14-18,19-5-3-7-21(29)15-19)13-12-23(24)25(30-31)26(32)33/h2-15H,16H2,1H3,(H,32,33)