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

Systemtic Name: (diphenylmethyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanoate Openeye Name: benzhydryl 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-butanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methylsulfonylbutanoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfonylbutanoate Traditional Name: 4-mesyl-2-phthalimido-butyric acid benzhydryl ester Formula: C26H23NO6S MolecularWeight: 477.52892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H23NO6S/c1-34(31,32)17-16-22(27-24(28)20-14-8-9-15-21(20)25(27)29)26(30)33-23(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-15,22-23H,16-17H2,1H3