tert-butyl (6R,7R)-3-[acetyloxy(methoxy)methyl]-7-azanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: tert-butyl (6R,7R)-3-[acetyloxy(methoxy)methyl]-7-azanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: tert-butyl (6R,7R)-3-[acetoxy(methoxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (6R,7R)-3-[acetyloxy(methoxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (6R,7R)-3-[acetyloxy(methoxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (6R,7R)-3-[acetoxy(methoxy)methyl]-7-amino-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester Formula: C15H22N2O6S MolecularWeight: 358.40998

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=C(N2C(C(C2=O)N)SC1)C(=O)OC(C)(C)C)OC

Isomeric SMILES

CC(=O)OC(C1=C(N2[C@@H]([C@@H](C2=O)N)SC1)C(=O)OC(C)(C)C)OC

InChI

InChI=1S/C15H22N2O6S/c1-7(18)22-14(21-5)8-6-24-12-9(16)11(19)17(12)10(8)13(20)23-15(2,3)4/h9,12,14H,6,16H2,1-5H3/t9-,12-,14?/m1/s1