3-methylidene-8-oxidanylidene-7-(propan-2-ylideneamino)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid

Systemtic Name: 3-methylidene-8-oxidanylidene-7-(propan-2-ylideneamino)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Openeye Name: 7-(isopropylideneamino)-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid CAS Name: 3-methylene-8-oxo-7-(propan-2-ylideneamino)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid IUPAC Name: 3-methylidene-8-oxo-7-(propan-2-ylideneamino)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Traditional Name: 7-(isopropylideneamino)-8-keto-3-methylene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1C2N(C1=O)C(C(=C)CS2)C(=O)O)C

Isomeric SMILES

CC(=NC1C2N(C1=O)C(C(=C)CS2)C(=O)O)C

InChI

InChI=1S/C11H14N2O3S/c1-5(2)12-7-9(14)13-8(11(15)16)6(3)4-17-10(7)13/h7-8,10H,3-4H2,1-2H3,(H,15,16)