[1-[4-(4-chloranylphenoxy)phenyl]-1-methylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine

Systemtic Name: [1-[4-(4-chloranylphenoxy)phenyl]-1-methylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine Openeye Name: [1-[4-(4-chlorophenoxy)phenyl]-1-methylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine CAS Name: [1-[4-(4-chlorophenoxy)phenyl]-1-methylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine IUPAC Name: [1-[4-(4-chlorophenoxy)phenyl]-1-methylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine Traditional Name: [1-[4-(4-chlorophenoxy)phenyl]-1-mesyl-2H-pyridin-1-ium-5-yl]methylamine Formula: C19H20ClN2O3S+ MolecularWeight: 391.8917

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN2O3S/c1-26(23,24)22(12-2-3-15(13-21)14-22)17-6-10-19(11-7-17)25-18-8-4-16(20)5-9-18/h2-11,14H,12-13,21H2,1H3/q+1