2-[1-[[3-(4-cyanophenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-2-ethyl-4-methylsulfonyloxy-piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[[3-(4-cyanophenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-2-ethyl-4-methylsulfonyloxy-piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[[3-(4-cyanophenyl)-2-oxo-oxazolidin-5-yl]methyl]-2-ethyl-4-methylsulfonyloxy-4-piperidyl]acetic acid CAS Name: 2-[1-[[3-(4-cyanophenyl)-2-oxo-5-oxazolidinyl]methyl]-2-ethyl-4-methylsulfonyloxy-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[[3-(4-cyanophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-2-ethyl-4-methylsulfonyloxypiperidin-4-yl]acetic acid Traditional Name: 2-[1-[[3-(4-cyanophenyl)-2-keto-oxazolidin-5-yl]methyl]-2-ethyl-4-methylsulfonyloxy-4-piperidyl]acetic acid Formula: C21H27N3O7S MolecularWeight: 465.51998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(CCN1CC2CN(C(=O)O2)C3=CC=C(C=C3)C#N)(CC(=O)O)OS(=O)(=O)C

Isomeric SMILES

CCC1CC(CCN1CC2CN(C(=O)O2)C3=CC=C(C=C3)C#N)(CC(=O)O)OS(=O)(=O)C

InChI

InChI=1S/C21H27N3O7S/c1-3-16-10-21(11-19(25)26,31-32(2,28)29)8-9-23(16)13-18-14-24(20(27)30-18)17-6-4-15(12-22)5-7-17/h4-7,16,18H,3,8-11,13-14H2,1-2H3,(H,25,26)