[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl] 1,2-dihydroacenaphthylene-5-carboxylate

Systemtic Name: [2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl] 1,2-dihydroacenaphthylene-5-carboxylate Openeye Name: [2-(4-methylsulfonylphenyl)-2-oxo-ethyl] 1,2-dihydroacenaphthylene-5-carboxylate CAS Name: 1,2-dihydroacenaphthylene-5-carboxylic acid [2-(4-methylsulfonylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylphenyl)-2-oxoethyl] 1,2-dihydroacenaphthylene-5-carboxylate Traditional Name: acenaphthene-5-carboxylic acid [2-keto-2-(4-mesylphenyl)ethyl] ester Formula: C22H18O5S MolecularWeight: 394.44032

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)COC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)COC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2

InChI

InChI=1S/C22H18O5S/c1-28(25,26)17-10-7-14(8-11-17)20(23)13-27-22(24)19-12-9-16-6-5-15-3-2-4-18(19)21(15)16/h2-4,7-12H,5-6,13H2,1H3