(4-oxidanylidene-2-bicyclo[3.2.1]oct-2-enyl) 3-(methoxymethyl)-2-methyl-4-methylsulfonyl-benzoate

Systemtic Name: (4-oxidanylidene-2-bicyclo[3.2.1]oct-2-enyl) 3-(methoxymethyl)-2-methyl-4-methylsulfonyl-benzoate Openeye Name: (4-oxo-2-bicyclo[3.2.1]oct-2-enyl) 3-(methoxymethyl)-2-methyl-4-methylsulfonyl-benzoate CAS Name: 3-(methoxymethyl)-2-methyl-4-methylsulfonylbenzoic acid (4-oxo-2-bicyclo[3.2.1]oct-2-enyl) ester IUPAC Name: (4-oxo-2-bicyclo[3.2.1]oct-2-enyl) 3-(methoxymethyl)-2-methyl-4-methylsulfonylbenzoate Traditional Name: 4-mesyl-3-(methoxymethyl)-2-methyl-benzoic acid (4-keto-2-bicyclo[3.2.1]oct-2-enyl) ester Formula: C19H22O6S MolecularWeight: 378.43938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1COC)S(=O)(=O)C)C(=O)OC2=CC(=O)C3CCC2C3

Isomeric SMILES

CC1=C(C=CC(=C1COC)S(=O)(=O)C)C(=O)OC2=CC(=O)C3CCC2C3

InChI

InChI=1S/C19H22O6S/c1-11-14(6-7-18(26(3,22)23)15(11)10-24-2)19(21)25-17-9-16(20)12-4-5-13(17)8-12/h6-7,9,12-13H,4-5,8,10H2,1-3H3