8-[3-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline

Systemtic Name: 8-[3-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline Openeye Name: 6-(1-methyl-1-methylsulfonyl-ethyl)-8-[3-(6-methyl-1-oxido-pyridin-1-ium-3-yl)phenyl]quinoline CAS Name: 8-[3-(6-methyl-1-oxido-3-pyridin-1-iumyl)phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline IUPAC Name: 8-[3-(6-methyl-1-oxidopyridin-1-ium-3-yl)phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline Traditional Name: 6-(1-mesyl-1-methyl-ethyl)-8-[3-(6-methyl-1-oxido-pyridin-1-ium-3-yl)phenyl]quinoline Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C=C1)C2=CC(=CC=C2)C3=C4C(=CC(=C3)C(C)(C)S(=O)(=O)C)C=CC=N4)[O-]

Isomeric SMILES

CC1=[N+](C=C(C=C1)C2=CC(=CC=C2)C3=C4C(=CC(=C3)C(C)(C)S(=O)(=O)C)C=CC=N4)[O-]

InChI

InChI=1S/C25H24N2O3S/c1-17-10-11-21(16-27(17)28)18-7-5-8-19(13-18)23-15-22(25(2,3)31(4,29)30)14-20-9-6-12-26-24(20)23/h5-16H,1-4H3