5-chloranyl-2-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)-3-(4-methylsulfonylphenyl)pyridine

Systemtic Name: 5-chloranyl-2-(6-methyl-1-oxidanidyl-pyridin-1-ium-3-yl)-3-(4-methylsulfonylphenyl)pyridine Openeye Name: 5-chloro-2-(6-methyl-1-oxido-pyridin-1-ium-3-yl)-3-(4-methylsulfonylphenyl)pyridine CAS Name: 5-chloro-2-(6-methyl-1-oxido-3-pyridin-1-iumyl)-3-(4-methylsulfonylphenyl)pyridine IUPAC Name: 5-chloro-2-(6-methyl-1-oxidopyridin-1-ium-3-yl)-3-(4-methylsulfonylphenyl)pyridine Traditional Name: 5-chloro-3-(4-mesylphenyl)-2-(6-methyl-1-oxido-pyridin-1-ium-3-yl)pyridine Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C=C1)C2=NC=C(C=C2C3=CC=C(C=C3)S(=O)(=O)C)Cl)[O-]

Isomeric SMILES

CC1=[N+](C=C(C=C1)C2=NC=C(C=C2C3=CC=C(C=C3)S(=O)(=O)C)Cl)[O-]

InChI

InChI=1S/C18H15ClN2O3S/c1-12-3-4-14(11-21(12)22)18-17(9-15(19)10-20-18)13-5-7-16(8-6-13)25(2,23)24/h3-11H,1-2H3