methyl 3-[4-[6-fluoranyl-2-(1-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl)indol-1-yl]sulfonylphenyl]propanoate

Systemtic Name: methyl 3-[4-[6-fluoranyl-2-(1-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-yl)indol-1-yl]sulfonylphenyl]propanoate Openeye Name: methyl 3-[4-[6-fluoro-2-(1-hydroxy-4-oxo-cyclohexa-2,5-dien-1-yl)indol-1-yl]sulfonylphenyl]propanoate CAS Name: 3-[4-[[6-fluoro-2-(1-hydroxy-4-oxo-1-cyclohexa-2,5-dienyl)-1-indolyl]sulfonyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[6-fluoro-2-(1-hydroxy-4-oxocyclohexa-2,5-dien-1-yl)indol-1-yl]sulfonylphenyl]propanoate Traditional Name: 3-[4-[6-fluoro-2-(1-hydroxy-4-keto-cyclohexa-2,5-dien-1-yl)indol-1-yl]sulfonylphenyl]propionic acid methyl ester Formula: C24H20FNO6S MolecularWeight: 469.482103

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2C(=CC3=C2C=C(C=C3)F)C4(C=CC(=O)C=C4)O

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2C(=CC3=C2C=C(C=C3)F)C4(C=CC(=O)C=C4)O

InChI

InChI=1S/C24H20FNO6S/c1-32-23(28)9-4-16-2-7-20(8-3-16)33(30,31)26-21-15-18(25)6-5-17(21)14-22(26)24(29)12-10-19(27)11-13-24/h2-3,5-8,10-15,29H,4,9H2,1H3