[4-methoxy-6-[(4-methylphenyl)sulfonyloxymethyl]pyridin-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [4-methoxy-6-[(4-methylphenyl)sulfonyloxymethyl]pyridin-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [4-methoxy-6-(p-tolylsulfonyloxymethyl)-2-pyridyl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-methoxy-6-[(4-methylphenyl)sulfonyloxymethyl]-2-pyridinyl]methyl ester IUPAC Name: [4-methoxy-6-[(4-methylphenyl)sulfonyloxymethyl]pyridin-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-methoxy-6-(tosyloxymethyl)-2-pyridyl]methyl ester Formula: C22H23NO7S2 MolecularWeight: 477.55052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2=CC(=CC(=N2)COS(=O)(=O)C3=CC=C(C=C3)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2=CC(=CC(=N2)COS(=O)(=O)C3=CC=C(C=C3)C)OC

InChI

InChI=1S/C22H23NO7S2/c1-16-4-8-21(9-5-16)31(24,25)29-14-18-12-20(28-3)13-19(23-18)15-30-32(26,27)22-10-6-17(2)7-11-22/h4-13H,14-15H2,1-3H3