(2R)-2-[5-(4-bromanylphenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanoate

Systemtic Name: (2R)-2-[5-(4-bromanylphenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-butanoate Openeye Name: (2R)-2-[5-(4-bromophenoxy)-1,3-dioxo-isoindolin-2-yl]-4-methylsulfonyl-butanoate CAS Name: (2R)-2-[5-(4-bromophenoxy)-1,3-dioxo-2-isoindolyl]-4-methylsulfonylbutanoate IUPAC Name: (2R)-2-[5-(4-bromophenoxy)-1,3-dioxoisoindol-2-yl]-4-methylsulfonylbutanoate Traditional Name: (2R)-2-[5-(4-bromophenoxy)-1,3-diketo-isoindolin-2-yl]-4-mesyl-butyrate Formula: C19H15BrNO7S- MolecularWeight: 481.2939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)[O-])N1C(=O)C2=C(C1=O)C=C(C=C2)OC3=CC=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)CC[C@H](C(=O)[O-])N1C(=O)C2=C(C1=O)C=C(C=C2)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H16BrNO7S/c1-29(26,27)9-8-16(19(24)25)21-17(22)14-7-6-13(10-15(14)18(21)23)28-12-4-2-11(20)3-5-12/h2-7,10,16H,8-9H2,1H3,(H,24,25)/p-1/t16-/m1/s1