(4-methoxyphenyl)methyl (6S,7R)-7-acetamido-3-methylidene-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl (6S,7R)-7-acetamido-3-methylidene-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl (6S,7R)-7-acetamido-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: (6S,7R)-7-acetamido-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (6S,7R)-7-acetamido-3-methylidene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: (6S,7R)-7-acetamido-8-keto-3-methylene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid p-anisyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C2N(C1=O)C(C(=C)CS2)C(=O)OCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)N[C@H]1[C@H]2N(C1=O)C(C(=C)CS2)C(=O)OCC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H20N2O5S/c1-10-9-26-17-14(19-11(2)21)16(22)20(17)15(10)18(23)25-8-12-4-6-13(24-3)7-5-12/h4-7,14-15,17H,1,8-9H2,2-3H3,(H,19,21)/t14-,15?,17+/m1/s1