7-(1-hydroxyethyl)-6-oxidanylidene-3-(phenylsulfinyl)bicyclo[3.2.0]hept-3-ene-4-carboxylic acid

Systemtic Name: 7-(1-hydroxyethyl)-6-oxidanylidene-3-(phenylsulfinyl)bicyclo[3.2.0]hept-3-ene-4-carboxylic acid Openeye Name: 3-(benzenesulfinyl)-7-(1-hydroxyethyl)-6-oxo-bicyclo[3.2.0]hept-3-ene-4-carboxylic acid CAS Name: 3-(benzenesulfinyl)-7-(1-hydroxyethyl)-6-oxo-4-bicyclo[3.2.0]hept-3-enecarboxylic acid IUPAC Name: 3-(benzenesulfinyl)-7-(1-hydroxyethyl)-6-oxobicyclo[3.2.0]hept-3-ene-4-carboxylic acid Traditional Name: 3-(benzenesulfinyl)-7-(1-hydroxyethyl)-6-keto-bicyclo[3.2.0]hept-3-ene-4-carboxylic acid Formula: C16H16O5S MolecularWeight: 320.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(C2C1=O)C(=O)O)S(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C1C2CC(=C(C2C1=O)C(=O)O)S(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C16H16O5S/c1-8(17)12-10-7-11(14(16(19)20)13(10)15(12)18)22(21)9-5-3-2-4-6-9/h2-6,8,10,12-13,17H,7H2,1H3,(H,19,20)