4-[4,6-dimethyl-3-(4-methylphenyl)sulfonyl-pyridin-1-ium-2-yl]morpholine

Systemtic Name: 4-[4,6-dimethyl-3-(4-methylphenyl)sulfonyl-pyridin-1-ium-2-yl]morpholine Openeye Name: 4-[4,6-dimethyl-3-(p-tolylsulfonyl)pyridin-1-ium-2-yl]morpholine CAS Name: 4-[4,6-dimethyl-3-(4-methylphenyl)sulfonyl-2-pyridin-1-iumyl]morpholine IUPAC Name: 4-[4,6-dimethyl-3-(4-methylphenyl)sulfonylpyridin-1-ium-2-yl]morpholine Traditional Name: 4-(4,6-dimethyl-3-tosyl-pyridin-1-ium-2-yl)morpholine Formula: C18H23N2O3S+ MolecularWeight: 347.45182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C([NH+]=C(C=C2C)C)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C([NH+]=C(C=C2C)C)N3CCOCC3

InChI

InChI=1S/C18H22N2O3S/c1-13-4-6-16(7-5-13)24(21,22)17-14(2)12-15(3)19-18(17)20-8-10-23-11-9-20/h4-7,12H,8-11H2,1-3H3/p+1