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

Systemtic Name: methyl 2-[4-[(E)-2-(2-hydroxyphenyl)ethenyl]pyridin-1-ium-1-yl]propanoate Openeye Name: methyl 2-[4-[(E)-2-(2-hydroxyphenyl)vinyl]pyridin-1-ium-1-yl]propanoate CAS Name: 2-[4-[(E)-2-(2-hydroxyphenyl)ethenyl]-1-pyridin-1-iumyl]propanoic acid methyl ester IUPAC Name: methyl 2-[4-[(E)-2-(2-hydroxyphenyl)ethenyl]pyridin-1-ium-1-yl]propanoate Traditional Name: 2-[4-[(E)-2-(2-hydroxyphenyl)vinyl]pyridin-1-ium-1-yl]propionic acid methyl ester Formula: C17H18NO3+ MolecularWeight: 284.32972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)[N+]1=CC=C(C=C1)C=CC2=CC=CC=C2O

Isomeric SMILES

CC(C(=O)OC)[N+]1=CC=C(C=C1)/C=C/C2=CC=CC=C2O

InChI

InChI=1S/C17H17NO3/c1-13(17(20)21-2)18-11-9-14(10-12-18)7-8-15-5-3-4-6-16(15)19/h3-13H,1-2H3/p+1