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

Systemtic Name: tert-butyl 6-(4-fluorophenyl)-3-(4-methylphenyl)sulfonyl-indole-1-carboxylate Openeye Name: tert-butyl 6-(4-fluorophenyl)-3-(p-tolylsulfonyl)indole-1-carboxylate CAS Name: 6-(4-fluorophenyl)-3-(4-methylphenyl)sulfonyl-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(4-fluorophenyl)-3-(4-methylphenyl)sulfonylindole-1-carboxylate Traditional Name: 6-(4-fluorophenyl)-3-tosyl-indole-1-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=CN(C3=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=CN(C3=C2C=CC(=C3)C4=CC=C(C=C4)F)C(=O)OC(C)(C)C

InChI

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