8-oxidanylidene-4-[(E)-3-oxidanylidene-3-prop-2-enoxy-prop-1-enyl]sulfanyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 8-oxidanylidene-4-[(E)-3-oxidanylidene-3-prop-2-enoxy-prop-1-enyl]sulfanyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 4-[(E)-3-allyloxy-3-oxo-prop-1-enyl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 8-oxo-4-[[(E)-3-oxo-3-prop-2-enoxyprop-1-enyl]thio]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 8-oxo-4-[(E)-3-oxo-3-prop-2-enoxyprop-1-enyl]sulfanyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 4-[[(E)-3-allyloxy-3-keto-prop-1-enyl]thio]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H13NO5S2 MolecularWeight: 327.37602

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C=CSC1C=C(N2C(S1)CC2=O)C(=O)O

Isomeric SMILES

C=CCOC(=O)/C=C/SC1C=C(N2C(S1)CC2=O)C(=O)O

InChI

InChI=1S/C13H13NO5S2/c1-2-4-19-11(16)3-5-20-12-6-8(13(17)18)14-9(15)7-10(14)21-12/h2-3,5-6,10,12H,1,4,7H2,(H,17,18)/b5-3+