ethoxycarbonyl (5R,6R)-7-oxidanylidene-6-(2-phenoxyethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: ethoxycarbonyl (5R,6R)-7-oxidanylidene-6-(2-phenoxyethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: ethoxycarbonyl (5R,6R)-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: (5R,6R)-7-oxo-6-[(1-oxo-2-phenoxyethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid ethoxycarbonyl ester IUPAC Name: ethoxycarbonyl (5R,6R)-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: (5R,6R)-7-keto-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid carbethoxy ester Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(=O)C1CSC2N1C(=O)C2NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)OC(=O)C1CS[C@H]2N1C(=O)[C@H]2NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O7S/c1-2-24-17(23)26-16(22)11-9-27-15-13(14(21)19(11)15)18-12(20)8-25-10-6-4-3-5-7-10/h3-7,11,13,15H,2,8-9H2,1H3,(H,18,20)/t11?,13-,15-/m1/s1