3-methoxy-3-methylsulfanyl-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid

Systemtic Name: 3-methoxy-3-methylsulfanyl-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Openeye Name: 3-methoxy-3-methylsulfanyl-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid CAS Name: 3-methoxy-3-(methylthio)-8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid IUPAC Name: 3-methoxy-3-methylsulfanyl-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Traditional Name: 8-keto-3-methoxy-3-(methylthio)-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Formula: C17H20N2O6S2 MolecularWeight: 412.4805

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CSC2C(C(=O)N2C1C(=O)O)NC(=O)COC3=CC=CC=C3)SC

Isomeric SMILES

COC1(CSC2C(C(=O)N2C1C(=O)O)NC(=O)COC3=CC=CC=C3)SC

InChI

InChI=1S/C17H20N2O6S2/c1-24-17(26-2)9-27-15-12(14(21)19(15)13(17)16(22)23)18-11(20)8-25-10-6-4-3-5-7-10/h3-7,12-13,15H,8-9H2,1-2H3,(H,18,20)(H,22,23)