3-[4-[(Z)-1-cyano-2-(4-dimethylaminophenyl)ethenyl]pyridin-1-ium-1-yl]propanoate

Systemtic Name: 3-[4-[(Z)-1-cyano-2-(4-dimethylaminophenyl)ethenyl]pyridin-1-ium-1-yl]propanoate Openeye Name: 3-[4-[(Z)-1-cyano-2-(4-dimethylaminophenyl)vinyl]pyridin-1-ium-1-yl]propanoate CAS Name: 3-[4-[(Z)-1-cyano-2-(4-dimethylaminophenyl)ethenyl]-1-pyridin-1-iumyl]propanoate IUPAC Name: 3-[4-[(Z)-1-cyano-2-(4-dimethylaminophenyl)ethenyl]pyridin-1-ium-1-yl]propanoate Traditional Name: 3-[4-[(Z)-1-cyano-2-(4-dimethylaminophenyl)vinyl]pyridin-1-ium-1-yl]propionate Formula: C19H19N3O2 MolecularWeight: 321.37306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C(C#N)C2=CC=[N+](C=C2)CCC(=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=CC=[N+](C=C2)CCC(=O)[O-]

InChI

InChI=1S/C19H19N3O2/c1-21(2)18-5-3-15(4-6-18)13-17(14-20)16-7-10-22(11-8-16)12-9-19(23)24/h3-8,10-11,13H,9,12H2,1-2H3