methyl (E)-3-[1-[(4-methoxyphenyl)methyl]pyridin-1-ium-3-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[1-[(4-methoxyphenyl)methyl]pyridin-1-ium-3-yl]prop-2-enoate Openeye Name: methyl (E)-3-[1-[(4-methoxyphenyl)methyl]pyridin-1-ium-3-yl]prop-2-enoate CAS Name: (E)-3-[1-[(4-methoxyphenyl)methyl]-3-pyridin-1-iumyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[1-[(4-methoxyphenyl)methyl]pyridin-1-ium-3-yl]prop-2-enoate Traditional Name: (E)-3-(1-p-anisylpyridin-1-ium-3-yl)acrylic acid methyl ester Formula: C17H18NO3+ MolecularWeight: 284.32972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C=CC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C[N+]2=CC=CC(=C2)/C=C/C(=O)OC

InChI

InChI=1S/C17H18NO3/c1-20-16-8-5-15(6-9-16)13-18-11-3-4-14(12-18)7-10-17(19)21-2/h3-12H,13H2,1-2H3/q+1/b10-7+