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

Systemtic Name: 3-(1-acetyloxyethyl)-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-(1-acetoxyethyl)-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-(1-acetyloxyethyl)-8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-(1-acetyloxyethyl)-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-(1-acetoxyethyl)-8-keto-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C19H20N2O7S MolecularWeight: 420.4363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N2C(C(C2=O)NC(=O)COC3=CC=CC=C3)SC1)C(=O)O)OC(=O)C

Isomeric SMILES

CC(C1=C(N2C(C(C2=O)NC(=O)COC3=CC=CC=C3)SC1)C(=O)O)OC(=O)C

InChI

InChI=1S/C19H20N2O7S/c1-10(28-11(2)22)13-9-29-18-15(17(24)21(18)16(13)19(25)26)20-14(23)8-27-12-6-4-3-5-7-12/h3-7,10,15,18H,8-9H2,1-2H3,(H,20,23)(H,25,26)