4-[3-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]phenyl]sulfonylmorpholine Formula: C16H18N2O4S2 MolecularWeight: 366.45512

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C16H18N2O4S2/c19-18-7-2-1-6-16(18)23-13-14-4-3-5-15(12-14)24(20,21)17-8-10-22-11-9-17/h1-7,12H,8-11,13H2