3-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]pyridin-1-ium-1-yl]propanoate

Systemtic Name: 3-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]pyridin-1-ium-1-yl]propanoate Openeye Name: 3-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]pyridin-1-ium-1-yl]propanoate CAS Name: 3-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1-pyridin-1-iumyl]propanoate IUPAC Name: 3-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]pyridin-1-ium-1-yl]propanoate Traditional Name: 3-[4-[(Z)-2-(3,4,5-trimethoxyphenyl)vinyl]pyridin-1-ium-1-yl]propionate Formula: C19H21NO5 MolecularWeight: 343.37374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC2=CC=[N+](C=C2)CCC(=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C\C2=CC=[N+](C=C2)CCC(=O)[O-]

InChI

InChI=1S/C19H21NO5/c1-23-16-12-15(13-17(24-2)19(16)25-3)5-4-14-6-9-20(10-7-14)11-8-18(21)22/h4-7,9-10,12-13H,8,11H2,1-3H3/b5-4-