[3-butyl-1-(4-methylphenyl)sulfonyl-indol-2-yl]-phenyl-methanol

Systemtic Name: [3-butyl-1-(4-methylphenyl)sulfonyl-indol-2-yl]-phenyl-methanol Openeye Name: [3-butyl-1-(p-tolylsulfonyl)indol-2-yl]-phenyl-methanol CAS Name: [3-butyl-1-(4-methylphenyl)sulfonyl-2-indolyl]-phenylmethanol IUPAC Name: [3-butyl-1-(4-methylphenyl)sulfonylindol-2-yl]-phenylmethanol Traditional Name: (3-butyl-1-tosyl-indol-2-yl)-phenyl-methanol Formula: C26H27NO3S MolecularWeight: 433.56248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)C(C4=CC=CC=C4)O

Isomeric SMILES

CCCCC1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)C(C4=CC=CC=C4)O

InChI

InChI=1S/C26H27NO3S/c1-3-4-12-23-22-13-8-9-14-24(22)27(25(23)26(28)20-10-6-5-7-11-20)31(29,30)21-17-15-19(2)16-18-21/h5-11,13-18,26,28H,3-4,12H2,1-2H3