(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanoic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-phthalimido-butyric acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C24H21NO7S MolecularWeight: 467.49104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C(CCSC)N3C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C(CCSC)N3C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C24H21NO7S/c1-13-19(26)8-7-15-14(11-20(27)32-21(13)15)12-31-24(30)18(9-10-33-2)25-22(28)16-5-3-4-6-17(16)23(25)29/h3-8,11,18,26H,9-10,12H2,1-2H3