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

Systemtic Name: 3-[4-[(Z)-2-(4-methoxycarbonylphenyl)ethenyl]pyridin-1-ium-1-yl]propanoate Openeye Name: 3-[4-[(Z)-2-(4-methoxycarbonylphenyl)vinyl]pyridin-1-ium-1-yl]propanoate CAS Name: 3-[4-[(Z)-2-(4-methoxycarbonylphenyl)ethenyl]-1-pyridin-1-iumyl]propanoate IUPAC Name: 3-[4-[(Z)-2-(4-methoxycarbonylphenyl)ethenyl]pyridin-1-ium-1-yl]propanoate Traditional Name: 3-[4-[(Z)-2-(4-carbomethoxyphenyl)vinyl]pyridin-1-ium-1-yl]propionate Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC2=CC=[N+](C=C2)CCC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO4/c1-23-18(22)16-6-4-14(5-7-16)2-3-15-8-11-19(12-9-15)13-10-17(20)21/h2-9,11-12H,10,13H2,1H3/b3-2-