3-[1-(4-methylphenyl)sulfonylhexyl]-2-phenyl-1H-indole

Systemtic Name: 3-[1-(4-methylphenyl)sulfonylhexyl]-2-phenyl-1H-indole Openeye Name: 2-phenyl-3-[1-(p-tolylsulfonyl)hexyl]-1H-indole CAS Name: 3-[1-(4-methylphenyl)sulfonylhexyl]-2-phenyl-1H-indole IUPAC Name: 3-[1-(4-methylphenyl)sulfonylhexyl]-2-phenyl-1H-indole Traditional Name: 2-phenyl-3-(1-tosylhexyl)-1H-indole Formula: C27H29NO2S MolecularWeight: 431.58966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C(NC2=CC=CC=C21)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCC(C1=C(NC2=CC=CC=C21)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H29NO2S/c1-3-4-6-15-25(31(29,30)22-18-16-20(2)17-19-22)26-23-13-9-10-14-24(23)28-27(26)21-11-7-5-8-12-21/h5,7-14,16-19,25,28H,3-4,6,15H2,1-2H3