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

Systemtic Name: (3-chlorophenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanoate Openeye Name: (3-chlorophenyl) 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methylsulfonylbutanoic acid (3-chlorophenyl) ester IUPAC Name: (3-chlorophenyl) 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfonylbutanoate Traditional Name: 4-mesyl-2-phthalimido-butyric acid (3-chlorophenyl) ester Formula: C19H16ClNO6S MolecularWeight: 421.85144

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)OC1=CC(=CC=C1)Cl)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)OC1=CC(=CC=C1)Cl)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H16ClNO6S/c1-28(25,26)10-9-16(19(24)27-13-6-4-5-12(20)11-13)21-17(22)14-7-2-3-8-15(14)18(21)23/h2-8,11,16H,9-10H2,1H3