6-methyl-6-(oxan-2-yl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-methyl-6-(oxan-2-yl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-methyl-7-oxo-6-tetrahydropyran-2-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-methyl-6-(2-oxanyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-methyl-6-(oxan-2-yl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 7-keto-6-methyl-6-tetrahydropyran-2-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2N(C1=O)C(=CS2)C(=O)O)C3CCCCO3

Isomeric SMILES

CC1(C2N(C1=O)C(=CS2)C(=O)O)C3CCCCO3

InChI

InChI=1S/C12H15NO4S/c1-12(8-4-2-3-5-17-8)10(16)13-7(9(14)15)6-18-11(12)13/h6,8,11H,2-5H2,1H3,(H,14,15)