4-[1-(4-methylsulfonylphenyl)sulfonylindol-2-yl]-4-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[1-(4-methylsulfonylphenyl)sulfonylindol-2-yl]-4-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-hydroxy-4-[1-(4-methylsulfonylphenyl)sulfonylindol-2-yl]cyclohexa-2,5-dien-1-one CAS Name: 4-hydroxy-4-[1-(4-methylsulfonylphenyl)sulfonyl-2-indolyl]-1-cyclohexa-2,5-dienone IUPAC Name: 4-hydroxy-4-[1-(4-methylsulfonylphenyl)sulfonylindol-2-yl]cyclohexa-2,5-dien-1-one Traditional Name: 4-hydroxy-4-[1-(4-mesylphenyl)sulfonylindol-2-yl]cyclohexa-2,5-dien-1-one Formula: C21H17NO6S2 MolecularWeight: 443.49278

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2C4(C=CC(=O)C=C4)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2C4(C=CC(=O)C=C4)O

InChI

InChI=1S/C21H17NO6S2/c1-29(25,26)17-6-8-18(9-7-17)30(27,28)22-19-5-3-2-4-15(19)14-20(22)21(24)12-10-16(23)11-13-21/h2-14,24H,1H3