8-(1-hydroxyethyl)-5-methylsulfonyl-9-oxidanylidene-1-azabicyclo[5.2.0]nona-2,4-diene-2-carboxylic acid

Systemtic Name: 8-(1-hydroxyethyl)-5-methylsulfonyl-9-oxidanylidene-1-azabicyclo[5.2.0]nona-2,4-diene-2-carboxylic acid Openeye Name: 8-(1-hydroxyethyl)-5-methylsulfonyl-9-oxo-1-azabicyclo[5.2.0]nona-2,4-diene-2-carboxylic acid CAS Name: 8-(1-hydroxyethyl)-5-methylsulfonyl-9-oxo-1-azabicyclo[5.2.0]nona-2,4-diene-2-carboxylic acid IUPAC Name: 8-(1-hydroxyethyl)-5-methylsulfonyl-9-oxo-1-azabicyclo[5.2.0]nona-2,4-diene-2-carboxylic acid Traditional Name: 8-(1-hydroxyethyl)-9-keto-5-mesyl-1-azabicyclo[5.2.0]nona-2,4-diene-2-carboxylic acid Formula: C12H15NO6S MolecularWeight: 301.3156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=CC=C(N2C1=O)C(=O)O)S(=O)(=O)C)O

Isomeric SMILES

CC(C1C2CC(=CC=C(N2C1=O)C(=O)O)S(=O)(=O)C)O

InChI

InChI=1S/C12H15NO6S/c1-6(14)10-9-5-7(20(2,18)19)3-4-8(12(16)17)13(9)11(10)15/h3-4,6,9-10,14H,5H2,1-2H3,(H,16,17)