(4,5-dimethoxy-2-methyl-phenyl)methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanoate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanoate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methylsulfonylbutanoic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfonylbutanoate Traditional Name: 4-mesyl-2-phthalimido-butyric acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C23H25NO8S MolecularWeight: 475.5115

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)C(CCS(=O)(=O)C)N2C(=O)C3=CC=CC=C3C2=O)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)C(CCS(=O)(=O)C)N2C(=O)C3=CC=CC=C3C2=O)OC)OC

InChI

InChI=1S/C23H25NO8S/c1-14-11-19(30-2)20(31-3)12-15(14)13-32-23(27)18(9-10-33(4,28)29)24-21(25)16-7-5-6-8-17(16)22(24)26/h5-8,11-12,18H,9-10,13H2,1-4H3