(2-phenoxyethanoylamino) (6S)-3-acetyloxy-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate

Systemtic Name: (2-phenoxyethanoylamino) (6S)-3-acetyloxy-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: [(2-phenoxyacetyl)amino] (6S)-3-acetoxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: (6S)-3-acetyloxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid [(1-oxo-2-phenoxyethyl)amino] ester IUPAC Name: [(2-phenoxyacetyl)amino] (6S)-3-acetyloxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: (6S)-3-acetoxy-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid [(2-phenoxyacetyl)amino] ester Formula: C18H20N2O7S MolecularWeight: 408.4256

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CSC2CC(=O)N2C1C(=O)ONC(=O)COC3=CC=CC=C3)C

Isomeric SMILES

CC(=O)OC1(CS[C@H]2CC(=O)N2C1C(=O)ONC(=O)COC3=CC=CC=C3)C

InChI

InChI=1S/C18H20N2O7S/c1-11(21)26-18(2)10-28-15-8-14(23)20(15)16(18)17(24)27-19-13(22)9-25-12-6-4-3-5-7-12/h3-7,15-16H,8-10H2,1-2H3,(H,19,22)/t15-,16?,18?/m0/s1