6-cyano-4-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1-(4-methoxyphenyl)pyridazin-1-ium-3-sulfonic acid

Systemtic Name: 6-cyano-4-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1-(4-methoxyphenyl)pyridazin-1-ium-3-sulfonic acid Openeye Name: 6-cyano-4-[(E)-2-(4-dimethylaminophenyl)vinyl]-1-(4-methoxyphenyl)pyridazin-1-ium-3-sulfonic acid CAS Name: 6-cyano-4-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1-(4-methoxyphenyl)-3-pyridazin-1-iumsulfonic acid IUPAC Name: 6-cyano-4-[(E)-2-(4-dimethylaminophenyl)ethenyl]-1-(4-methoxyphenyl)pyridazin-1-ium-3-sulfonic acid Traditional Name: 6-cyano-4-[(E)-2-(4-dimethylaminophenyl)vinyl]-1-(4-methoxyphenyl)pyridazin-1-ium-3-sulfonic acid Formula: C22H21N4O4S+ MolecularWeight: 437.49154

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC2=C(N=[N+](C(=C2)C#N)C3=CC=C(C=C3)OC)S(=O)(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C2=C(N=[N+](C(=C2)C#N)C3=CC=C(C=C3)OC)S(=O)(=O)O

InChI

InChI=1S/C22H20N4O4S/c1-25(2)18-8-5-16(6-9-18)4-7-17-14-20(15-23)26(24-22(17)31(27,28)29)19-10-12-21(30-3)13-11-19/h4-14H,1-3H3/p+1