2,6-bis[(E)-2-(4-methoxyphenyl)ethenyl]-1-methyl-pyridin-1-ium; 4-methylbenzenesulfonic acid

Systemtic Name: 2,6-bis[(E)-2-(4-methoxyphenyl)ethenyl]-1-methyl-pyridin-1-ium; 4-methylbenzenesulfonic acid Openeye Name: 2,6-bis[(E)-2-(4-methoxyphenyl)vinyl]-1-methyl-pyridin-1-ium; 4-methylbenzenesulfonic acid CAS Name: 2,6-bis[(E)-2-(4-methoxyphenyl)ethenyl]-1-methylpyridin-1-ium; 4-methylbenzenesulfonic acid IUPAC Name: 2,6-bis[(E)-2-(4-methoxyphenyl)ethenyl]-1-methylpyridin-1-ium; 4-methylbenzenesulfonic acid Traditional Name: 2,6-bis[(E)-2-(4-methoxyphenyl)vinyl]-1-methyl-pyridin-1-ium; tosylic acid Formula: C31H32NO5S+ MolecularWeight: 530.65448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C[N+]1=C(C=CC=C1C=CC2=CC=C(C=C2)OC)C=CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C[N+]1=C(C=CC=C1/C=C/C2=CC=C(C=C2)OC)/C=C/C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H24NO2.C7H8O3S/c1-25-21(13-7-19-9-15-23(26-2)16-10-19)5-4-6-22(25)14-8-20-11-17-24(27-3)18-12-20;1-6-2-4-7(5-3-6)11(8,9)10/h4-18H,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/b13-7+,14-8+;