3-ethoxycarbonyl-8-oxidanylidene-7-[[2-phenyl-2-(prop-2-enoxycarbonylamino)ethanoyl]amino]-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 3-ethoxycarbonyl-8-oxidanylidene-7-[[2-phenyl-2-(prop-2-enoxycarbonylamino)ethanoyl]amino]-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-[[2-(allyloxycarbonylamino)-2-phenyl-acetyl]amino]-3-ethoxycarbonyl-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-ethoxycarbonyl-8-oxo-7-[[1-oxo-2-[[oxo(prop-2-enoxy)methyl]amino]-2-phenylethyl]amino]-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 3-ethoxycarbonyl-8-oxo-7-[[2-phenyl-2-(prop-2-enoxycarbonylamino)acetyl]amino]-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[[2-(allyloxycarbonylamino)-2-phenyl-acetyl]amino]-3-carbethoxy-8-keto-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C23H24N3O8- MolecularWeight: 470.45196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(CC1)C(C2=O)NC(=O)C(C3=CC=CC=C3)NC(=O)OCC=C)C(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N2C(CC1)C(C2=O)NC(=O)C(C3=CC=CC=C3)NC(=O)OCC=C)C(=O)[O-]

InChI

InChI=1S/C23H25N3O8/c1-3-12-34-23(32)25-16(13-8-6-5-7-9-13)19(27)24-17-15-11-10-14(22(31)33-4-2)18(21(29)30)26(15)20(17)28/h3,5-9,15-17H,1,4,10-12H2,2H3,(H,24,27)(H,25,32)(H,29,30)/p-1