[4-(4-ethoxy-3-methyl-phenyl)sulfonylphenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-(4-ethoxy-3-methyl-phenyl)sulfonylphenyl] 4-methylbenzenesulfonate Openeye Name: [4-(4-ethoxy-3-methyl-phenyl)sulfonylphenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(4-ethoxy-3-methylphenyl)sulfonylphenyl] ester IUPAC Name: [4-(4-ethoxy-3-methylphenyl)sulfonylphenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-(4-ethoxy-3-methyl-phenyl)sulfonylphenyl] ester Formula: C22H22O6S2 MolecularWeight: 446.53648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H22O6S2/c1-4-27-22-14-13-21(15-17(22)3)29(23,24)19-11-7-18(8-12-19)28-30(25,26)20-9-5-16(2)6-10-20/h5-15H,4H2,1-3H3