[6-hexyl-1-(4-methylphenyl)sulfonyl-indol-4-yl]-phenyl-methanone

Systemtic Name: [6-hexyl-1-(4-methylphenyl)sulfonyl-indol-4-yl]-phenyl-methanone Openeye Name: [6-hexyl-1-(p-tolylsulfonyl)indol-4-yl]-phenyl-methanone CAS Name: [6-hexyl-1-(4-methylphenyl)sulfonyl-4-indolyl]-phenylmethanone IUPAC Name: [6-hexyl-1-(4-methylphenyl)sulfonylindol-4-yl]-phenylmethanone Traditional Name: (6-hexyl-1-tosyl-indol-4-yl)-phenyl-methanone Formula: C28H29NO3S MolecularWeight: 459.59976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=CN2S(=O)(=O)C3=CC=C(C=C3)C)C(=C1)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCCCC1=CC2=C(C=CN2S(=O)(=O)C3=CC=C(C=C3)C)C(=C1)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H29NO3S/c1-3-4-5-7-10-22-19-26(28(30)23-11-8-6-9-12-23)25-17-18-29(27(25)20-22)33(31,32)24-15-13-21(2)14-16-24/h6,8-9,11-20H,3-5,7,10H2,1-2H3