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

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanoate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methylsulfonylbutanoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfonylbutanoate Traditional Name: 4-mesyl-2-phthalimido-butyric acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C23H19NO8S MolecularWeight: 469.46386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C(CCS(=O)(=O)C)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C(CCS(=O)(=O)C)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H19NO8S/c1-13-11-20(25)32-19-12-14(7-8-15(13)19)31-23(28)18(9-10-33(2,29)30)24-21(26)16-5-3-4-6-17(16)22(24)27/h3-8,11-12,18H,9-10H2,1-2H3