7-ethoxy-3-methyl-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-ethoxy-3-methyl-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-ethoxy-3-methyl-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-ethoxy-3-methyl-8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-ethoxy-3-methyl-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-ethoxy-8-keto-3-methyl-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C2N(C1=O)C(=C(CS2)C)C(=O)O)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCOC1(C2N(C1=O)C(=C(CS2)C)C(=O)O)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O6S/c1-3-26-18(19-13(21)9-25-12-7-5-4-6-8-12)16(24)20-14(15(22)23)11(2)10-27-17(18)20/h4-8,17H,3,9-10H2,1-2H3,(H,19,21)(H,22,23)