8-[3-(4-chloranyl-1-oxidanidyl-pyridin-1-ium-3-yl)phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline

Systemtic Name: 8-[3-(4-chloranyl-1-oxidanidyl-pyridin-1-ium-3-yl)phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline Openeye Name: 8-[3-(4-chloro-1-oxido-pyridin-1-ium-3-yl)phenyl]-6-(1-methyl-1-methylsulfonyl-ethyl)quinoline CAS Name: 8-[3-(4-chloro-1-oxido-3-pyridin-1-iumyl)phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline IUPAC Name: 8-[3-(4-chloro-1-oxidopyridin-1-ium-3-yl)phenyl]-6-(2-methylsulfonylpropan-2-yl)quinoline Traditional Name: 8-[3-(4-chloro-1-oxido-pyridin-1-ium-3-yl)phenyl]-6-(1-mesyl-1-methyl-ethyl)quinoline Formula: C24H21ClN2O3S MolecularWeight: 452.95314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C4=C(C=C[N+](=C4)[O-])Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C4=C(C=C[N+](=C4)[O-])Cl)S(=O)(=O)C

InChI

InChI=1S/C24H21ClN2O3S/c1-24(2,31(3,29)30)19-13-18-8-5-10-26-23(18)20(14-19)16-6-4-7-17(12-16)21-15-27(28)11-9-22(21)25/h4-15H,1-3H3