propyl (6R,7R)-3-methyl-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: propyl (6R,7R)-3-methyl-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: propyl (6R,7R)-3-methyl-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (6R,7R)-3-methyl-8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid propyl ester IUPAC Name: propyl (6R,7R)-3-methyl-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (6R,7R)-8-keto-3-methyl-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid propyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(CSC2N1C(=O)C2NC(=O)COC3=CC=CC=C3)C

Isomeric SMILES

CCCOC(=O)C1=C(CS[C@H]2N1C(=O)[C@H]2NC(=O)COC3=CC=CC=C3)C

InChI

InChI=1S/C19H22N2O5S/c1-3-9-25-19(24)16-12(2)11-27-18-15(17(23)21(16)18)20-14(22)10-26-13-7-5-4-6-8-13/h4-8,15,18H,3,9-11H2,1-2H3,(H,20,22)/t15-,18-/m1/s1