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

Systemtic Name: methyl (E)-3-(3-methylimidazol-3-ium-1-yl)-3-phenyl-prop-2-enoate Openeye Name: methyl (E)-3-(3-methylimidazol-3-ium-1-yl)-3-phenyl-prop-2-enoate CAS Name: (E)-3-(3-methyl-1-imidazol-3-iumyl)-3-phenyl-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(3-methylimidazol-3-ium-1-yl)-3-phenylprop-2-enoate Traditional Name: (E)-3-(3-methylimidazol-3-ium-1-yl)-3-phenyl-acrylic acid methyl ester Formula: C14H15N2O2+ MolecularWeight: 243.2811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N2O2/c1-15-8-9-16(11-15)13(10-14(17)18-2)12-6-4-3-5-7-12/h3-11H,1-2H3/q+1/b13-10+