O4-ethyl O1-(phenylsulfonyl) 3-ethyl-2,5-bis(oxidanyl)benzene-1,4-dicarboxylate

Systemtic Name: O4-ethyl O1-(phenylsulfonyl) 3-ethyl-2,5-bis(oxidanyl)benzene-1,4-dicarboxylate Openeye Name: O1-(benzenesulfonyl) O4-ethyl 3-ethyl-2,5-dihydroxy-benzene-1,4-dicarboxylate CAS Name: 3-ethyl-2,5-dihydroxybenzene-1,4-dicarboxylic acid O1-(benzenesulfonyl) ester O4-ethyl ester IUPAC Name: 1-O-(benzenesulfonyl) 4-O-ethyl 3-ethyl-2,5-dihydroxybenzene-1,4-dicarboxylate Traditional Name: 3-ethyl-2,5-dihydroxy-benzene-1,4-dicarboxylic acid O1-besyl ester O4-ethyl ester Formula: C18H18O8S MolecularWeight: 394.39572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1C(=O)OCC)O)C(=O)OS(=O)(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCC1=C(C(=CC(=C1C(=O)OCC)O)C(=O)OS(=O)(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C18H18O8S/c1-3-12-15(18(22)25-4-2)14(19)10-13(16(12)20)17(21)26-27(23,24)11-8-6-5-7-9-11/h5-10,19-20H,3-4H2,1-2H3