8-oxidanylidene-7-[(E)-2-pyrazin-2-ylethenyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 8-oxidanylidene-7-[(E)-2-pyrazin-2-ylethenyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 8-oxo-7-[(E)-2-pyrazin-2-ylvinyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 8-oxo-7-[(E)-2-(2-pyrazinyl)ethenyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 8-oxo-7-[(E)-2-pyrazin-2-ylethenyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-[(E)-2-pyrazin-2-ylvinyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H11N3O3S MolecularWeight: 289.30974

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N2C(S1)C(C2=O)C=CC3=NC=CN=C3)C(=O)O

Isomeric SMILES

C1C=C(N2C(S1)C(C2=O)/C=C/C3=NC=CN=C3)C(=O)O

InChI

InChI=1S/C13H11N3O3S/c17-11-9(2-1-8-7-14-4-5-15-8)12-16(11)10(13(18)19)3-6-20-12/h1-5,7,9,12H,6H2,(H,18,19)/b2-1+