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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C2=C(N1)C=C(C=C2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCOC(=O)C1=C(C2=C(N1)C=C(C=C2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H24FNO4S/c1-3-4-15-32-26(29)24-25(33(30,31)21-12-5-17(2)6-13-21)22-14-9-19(16-23(22)28-24)18-7-10-20(27)11-8-18/h5-14,16,28H,3-4,15H2,1-2H3