(E)-3-(1-methylpyridin-1-ium-2-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1-methylpyridin-1-ium-2-yl)prop-2-enoic acid Openeye Name: (E)-3-(1-methylpyridin-1-ium-2-yl)prop-2-enoic acid CAS Name: (E)-3-(1-methyl-2-pyridin-1-iumyl)-2-propenoic acid IUPAC Name: (E)-3-(1-methylpyridin-1-ium-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-methylpyridin-1-ium-2-yl)acrylic acid Formula: C9H10NO2+ MolecularWeight: 164.1812

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C=CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO2/c1-10-7-3-2-4-8(10)5-6-9(11)12/h2-7H,1H3/p+1/b6-5+