methyl (E)-3-(1,3-dimethylimidazol-1-ium-4-yl)prop-2-enoate

Systemtic Name: methyl (E)-3-(1,3-dimethylimidazol-1-ium-4-yl)prop-2-enoate Openeye Name: methyl (E)-3-(1,3-dimethylimidazol-1-ium-4-yl)prop-2-enoate CAS Name: (E)-3-(1,3-dimethyl-4-imidazol-1-iumyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(1,3-dimethylimidazol-1-ium-4-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-dimethylimidazol-1-ium-4-yl)acrylic acid methyl ester Formula: C9H13N2O2+ MolecularWeight: 181.21172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C=C1C=CC(=O)OC)C

Isomeric SMILES

CN1C=[N+](C=C1/C=C/C(=O)OC)C

InChI

InChI=1S/C9H13N2O2/c1-10-6-8(11(2)7-10)4-5-9(12)13-3/h4-7H,1-3H3/q+1/b5-4+