methyl (E)-3-(1-methylpyridin-1-ium-3-yl)prop-2-enoate

Systemtic Name: methyl (E)-3-(1-methylpyridin-1-ium-3-yl)prop-2-enoate Openeye Name: methyl (E)-3-(1-methylpyridin-1-ium-3-yl)prop-2-enoate CAS Name: (E)-3-(1-methyl-3-pyridin-1-iumyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(1-methylpyridin-1-ium-3-yl)prop-2-enoate Traditional Name: (E)-3-(1-methylpyridin-1-ium-3-yl)acrylic acid methyl ester Formula: C10H12NO2+ MolecularWeight: 178.20778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12NO2/c1-11-7-3-4-9(8-11)5-6-10(12)13-2/h3-8H,1-2H3/q+1/b6-5+