8-oxidanylidene-3-(oxolan-3-yl)-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 8-oxidanylidene-3-(oxolan-3-yl)-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 8-oxo-7-[(2-phenylacetyl)amino]-3-tetrahydrofuran-3-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-3-(3-oxolanyl)-7-[(1-oxo-2-phenylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 8-oxo-3-(oxolan-3-yl)-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-7-[(2-phenylacetyl)amino]-3-tetrahydrofuran-3-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C19H19N2O5S- MolecularWeight: 387.42956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C2=C(N3C(C(C3=O)NC(=O)CC4=CC=CC=C4)SC2)C(=O)[O-]

Isomeric SMILES

C1COCC1C2=C(N3C(C(C3=O)NC(=O)CC4=CC=CC=C4)SC2)C(=O)[O-]

InChI

InChI=1S/C19H20N2O5S/c22-14(8-11-4-2-1-3-5-11)20-15-17(23)21-16(19(24)25)13(10-27-18(15)21)12-6-7-26-9-12/h1-5,12,15,18H,6-10H2,(H,20,22)(H,24,25)/p-1