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

Systemtic Name: tert-butyl (6S,7R)-7-acetamido-3-methylidene-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: tert-butyl (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 tert-butyl ester IUPAC Name: tert-butyl (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 tert-butyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4S/c1-7-6-21-12-9(15-8(2)17)11(18)16(12)10(7)13(19)20-14(3,4)5/h9-10,12H,1,6H2,2-5H3,(H,15,17)/t9-,10?,12+/m1/s1