[4-[(2,6-dimethylpyridin-4-yl)methoxy]phenyl] [4-(oxidanylcarbamoyl)oxan-4-yl]methanesulfinate

Systemtic Name: [4-[(2,6-dimethylpyridin-4-yl)methoxy]phenyl] [4-(oxidanylcarbamoyl)oxan-4-yl]methanesulfinate Openeye Name: [4-[(2,6-dimethyl-4-pyridyl)methoxy]phenyl] [4-(hydroxycarbamoyl)tetrahydropyran-4-yl]methanesulfinate CAS Name: [4-[(hydroxyamino)-oxomethyl]-4-oxanyl]methanesulfinic acid [4-[(2,6-dimethyl-4-pyridinyl)methoxy]phenyl] ester IUPAC Name: [4-[(2,6-dimethylpyridin-4-yl)methoxy]phenyl] [4-(hydroxycarbamoyl)oxan-4-yl]methanesulfinate Traditional Name: [4-(hydroxycarbamoyl)tetrahydropyran-4-yl]methanesulfinic acid [4-[(2,6-dimethyl-4-pyridyl)methoxy]phenyl] ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)COC2=CC=C(C=C2)OS(=O)CC3(CCOCC3)C(=O)NO

Isomeric SMILES

CC1=CC(=CC(=N1)C)COC2=CC=C(C=C2)OS(=O)CC3(CCOCC3)C(=O)NO

InChI

InChI=1S/C21H26N2O6S/c1-15-11-17(12-16(2)22-15)13-28-18-3-5-19(6-4-18)29-30(26)14-21(20(24)23-25)7-9-27-10-8-21/h3-6,11-12,25H,7-10,13-14H2,1-2H3,(H,23,24)