ethyl 1-[[3-(4-cyanophenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-4-methylsulfonyloxy-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[3-(4-cyanophenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-4-methylsulfonyloxy-piperidine-4-carboxylate Openeye Name: ethyl 1-[[3-(4-cyanophenyl)-2-oxo-oxazolidin-5-yl]methyl]-4-methylsulfonyloxy-piperidine-4-carboxylate CAS Name: 1-[[3-(4-cyanophenyl)-2-oxo-5-oxazolidinyl]methyl]-4-methylsulfonyloxy-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-(4-cyanophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-methylsulfonyloxypiperidine-4-carboxylate Traditional Name: 1-[[3-(4-cyanophenyl)-2-keto-oxazolidin-5-yl]methyl]-4-methylsulfonyloxy-isonipecotic acid ethyl ester Formula: C20H25N3O7S MolecularWeight: 451.4934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2CN(C(=O)O2)C3=CC=C(C=C3)C#N)OS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2CN(C(=O)O2)C3=CC=C(C=C3)C#N)OS(=O)(=O)C

InChI

InChI=1S/C20H25N3O7S/c1-3-28-18(24)20(30-31(2,26)27)8-10-22(11-9-20)13-17-14-23(19(25)29-17)16-6-4-15(12-21)5-7-16/h4-7,17H,3,8-11,13-14H2,1-2H3