3-methyl-1-[1-(4-methylphenyl)sulfonylindol-4-yl]-3-oxidanyl-butan-1-one

Systemtic Name: 3-methyl-1-[1-(4-methylphenyl)sulfonylindol-4-yl]-3-oxidanyl-butan-1-one Openeye Name: 3-hydroxy-3-methyl-1-[1-(p-tolylsulfonyl)indol-4-yl]butan-1-one CAS Name: 3-hydroxy-3-methyl-1-[1-(4-methylphenyl)sulfonyl-4-indolyl]-1-butanone IUPAC Name: 3-hydroxy-3-methyl-1-[1-(4-methylphenyl)sulfonylindol-4-yl]butan-1-one Traditional Name: 3-hydroxy-3-methyl-1-(1-tosylindol-4-yl)butan-1-one Formula: C20H21NO4S MolecularWeight: 371.45004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C(C=CC=C32)C(=O)CC(C)(C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C(C=CC=C32)C(=O)CC(C)(C)O

InChI

InChI=1S/C20H21NO4S/c1-14-7-9-15(10-8-14)26(24,25)21-12-11-16-17(5-4-6-18(16)21)19(22)13-20(2,3)23/h4-12,23H,13H2,1-3H3