7-[(E)-3-(dimethylamino)-3-oxidanylidene-prop-1-enyl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 7-[(E)-3-(dimethylamino)-3-oxidanylidene-prop-1-enyl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-[(E)-3-(dimethylamino)-3-oxo-prop-1-enyl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[[(E)-3-(dimethylamino)-3-oxoprop-1-enyl]thio]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 7-[(E)-3-(dimethylamino)-3-oxoprop-1-enyl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[[(E)-3-(dimethylamino)-3-keto-prop-1-enyl]thio]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C12H13N2O4S2- MolecularWeight: 313.37262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C=CSC1C2N(C1=O)C(=CCS2)C(=O)[O-]

Isomeric SMILES

CN(C)C(=O)/C=C/SC1C2N(C1=O)C(=CCS2)C(=O)[O-]

InChI

InChI=1S/C12H14N2O4S2/c1-13(2)8(15)4-6-19-9-10(16)14-7(12(17)18)3-5-20-11(9)14/h3-4,6,9,11H,5H2,1-2H3,(H,17,18)/p-1/b6-4+