6-(1-hydroxyethyl)-7-oxidanylidene-3-(4-prop-2-enoxycarbonylthiomorpholin-3-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 6-(1-hydroxyethyl)-7-oxidanylidene-3-(4-prop-2-enoxycarbonylthiomorpholin-3-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3-(4-allyloxycarbonylthiomorpholin-3-yl)-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(1-hydroxyethyl)-7-oxo-3-[4-[oxo(prop-2-enoxy)methyl]-3-thiomorpholinyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 6-(1-hydroxyethyl)-7-oxo-3-(4-prop-2-enoxycarbonylthiomorpholin-3-yl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-(4-allyloxycarbonylthiomorpholin-3-yl)-6-(1-hydroxyethyl)-7-keto-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C17H21N2O6S- MolecularWeight: 381.42344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)[O-])C3CSCCN3C(=O)OCC=C)O

Isomeric SMILES

CC(C1C2CC(=C(N2C1=O)C(=O)[O-])C3CSCCN3C(=O)OCC=C)O

InChI

InChI=1S/C17H22N2O6S/c1-3-5-25-17(24)18-4-6-26-8-12(18)10-7-11-13(9(2)20)15(21)19(11)14(10)16(22)23/h3,9,11-13,20H,1,4-8H2,2H3,(H,22,23)/p-1