methyl 2-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]pyridin-1-ium-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]pyridin-1-ium-1-yl]ethanoate Openeye Name: methyl 2-[4-[(E)-2-(4-hydroxyphenyl)vinyl]pyridin-1-ium-1-yl]acetate CAS Name: 2-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]-1-pyridin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]pyridin-1-ium-1-yl]acetate Traditional Name: 2-[4-[(E)-2-(4-hydroxyphenyl)vinyl]pyridin-1-ium-1-yl]acetic acid methyl ester Formula: C16H16NO3+ MolecularWeight: 270.30314

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[N+]1=CC=C(C=C1)C=CC2=CC=C(C=C2)O

Isomeric SMILES

COC(=O)C[N+]1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)O

InChI

InChI=1S/C16H15NO3/c1-20-16(19)12-17-10-8-14(9-11-17)3-2-13-4-6-15(18)7-5-13/h2-11H,12H2,1H3/p+1