[5-[(4-chlorophenyl)-oxidanyl-methyl]-2-methyl-4-[(4-methylphenyl)sulfonyloxymethyl]pyridin-3-yl] ethanoate

Systemtic Name: [5-[(4-chlorophenyl)-oxidanyl-methyl]-2-methyl-4-[(4-methylphenyl)sulfonyloxymethyl]pyridin-3-yl] ethanoate Openeye Name: [5-[(4-chlorophenyl)-hydroxy-methyl]-2-methyl-4-(p-tolylsulfonyloxymethyl)-3-pyridyl] acetate CAS Name: acetic acid [5-[(4-chlorophenyl)-hydroxymethyl]-2-methyl-4-[(4-methylphenyl)sulfonyloxymethyl]-3-pyridinyl] ester IUPAC Name: [5-[(4-chlorophenyl)-hydroxymethyl]-2-methyl-4-[(4-methylphenyl)sulfonyloxymethyl]pyridin-3-yl] acetate Traditional Name: acetic acid [5-[(4-chlorophenyl)-hydroxy-methyl]-2-methyl-4-(tosyloxymethyl)-3-pyridyl] ester Formula: C23H22ClNO6S MolecularWeight: 475.94188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2=C(C(=NC=C2C(C3=CC=C(C=C3)Cl)O)C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2=C(C(=NC=C2C(C3=CC=C(C=C3)Cl)O)C)OC(=O)C

InChI

InChI=1S/C23H22ClNO6S/c1-14-4-10-19(11-5-14)32(28,29)30-13-21-20(12-25-15(2)23(21)31-16(3)26)22(27)17-6-8-18(24)9-7-17/h4-12,22,27H,13H2,1-3H3