tert-butyl 6-(4-fluorophenyl)-3-(4-methylphenyl)sulfonyl-1H-indole-2-carboxylate

Systemtic Name: tert-butyl 6-(4-fluorophenyl)-3-(4-methylphenyl)sulfonyl-1H-indole-2-carboxylate Openeye Name: tert-butyl 6-(4-fluorophenyl)-3-(p-tolylsulfonyl)-1H-indole-2-carboxylate CAS Name: 6-(4-fluorophenyl)-3-(4-methylphenyl)sulfonyl-1H-indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(4-fluorophenyl)-3-(4-methylphenyl)sulfonyl-1H-indole-2-carboxylate Traditional Name: 6-(4-fluorophenyl)-3-tosyl-1H-indole-2-carboxylic acid tert-butyl ester Formula: C26H24FNO4S MolecularWeight: 465.536463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=CC(=C3)C4=CC=C(C=C4)F)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=C2C=CC(=C3)C4=CC=C(C=C4)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H24FNO4S/c1-16-5-12-20(13-6-16)33(30,31)24-21-14-9-18(17-7-10-19(27)11-8-17)15-22(21)28-23(24)25(29)32-26(2,3)4/h5-15,28H,1-4H3