(7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate

Systemtic Name: (7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate Openeye Name: (7-fluoro-1-methyl-3-oxo-indan-4-yl) 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanoic acid (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-phthalimido-butyric acid (7-fluoro-3-keto-1-methyl-indan-4-yl) ester Formula: C23H20FNO5S MolecularWeight: 441.472003

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C(CCSC)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C(CCSC)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H20FNO5S/c1-12-11-17(26)20-18(8-7-15(24)19(12)20)30-23(29)16(9-10-31-2)25-21(27)13-5-3-4-6-14(13)22(25)28/h3-8,12,16H,9-11H2,1-2H3