2-[[3-(4-methylsulfonylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]butanedioic acid

Systemtic Name: 2-[[3-(4-methylsulfonylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]butanedioic acid Openeye Name: 2-[[3-(4-methylsulfonylphenyl)-2-oxo-oxazolidin-5-yl]methyl]butanedioic acid CAS Name: 2-[[3-(4-methylsulfonylphenyl)-2-oxo-5-oxazolidinyl]methyl]butanedioic acid IUPAC Name: 2-[[3-(4-methylsulfonylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]butanedioic acid Traditional Name: 2-[[2-keto-3-(4-mesylphenyl)oxazolidin-5-yl]methyl]succinic acid Formula: C15H17NO8S MolecularWeight: 371.36238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2CC(OC2=O)CC(CC(=O)O)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2CC(OC2=O)CC(CC(=O)O)C(=O)O

InChI

InChI=1S/C15H17NO8S/c1-25(22,23)12-4-2-10(3-5-12)16-8-11(24-15(16)21)6-9(14(19)20)7-13(17)18/h2-5,9,11H,6-8H2,1H3,(H,17,18)(H,19,20)