4-[5-fluoranyl-1-(4-methylphenyl)sulfonyl-indol-2-yl]-4-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-fluoranyl-1-(4-methylphenyl)sulfonyl-indol-2-yl]-4-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-fluoro-1-(p-tolylsulfonyl)indol-2-yl]-4-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[5-fluoro-1-(4-methylphenyl)sulfonyl-2-indolyl]-4-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-fluoro-1-(4-methylphenyl)sulfonylindol-2-yl]-4-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-(5-fluoro-1-tosyl-indol-2-yl)-4-hydroxy-cyclohexa-2,5-dien-1-one Formula: C21H16FNO4S MolecularWeight: 397.419443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)F)C=C2C4(C=CC(=O)C=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)F)C=C2C4(C=CC(=O)C=C4)O

InChI

InChI=1S/C21H16FNO4S/c1-14-2-5-18(6-3-14)28(26,27)23-19-7-4-16(22)12-15(19)13-20(23)21(25)10-8-17(24)9-11-21/h2-13,25H,1H3