ethyl (E)-3-(5-nitrofuran-2-yl)-2-pyridin-1-ium-1-yl-prop-2-enoate

Systemtic Name: ethyl (E)-3-(5-nitrofuran-2-yl)-2-pyridin-1-ium-1-yl-prop-2-enoate Openeye Name: ethyl (E)-3-(5-nitro-2-furyl)-2-pyridin-1-ium-1-yl-prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-(1-pyridin-1-iumyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(5-nitrofuran-2-yl)-2-pyridin-1-ium-1-ylprop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)-2-pyridin-1-ium-1-yl-acrylic acid ethyl ester Formula: C14H13N2O5+ MolecularWeight: 289.26342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(O1)[N+](=O)[O-])[N+]2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C(=C\C1=CC=C(O1)[N+](=O)[O-])/[N+]2=CC=CC=C2

InChI

InChI=1S/C14H13N2O5/c1-2-20-14(17)12(15-8-4-3-5-9-15)10-11-6-7-13(21-11)16(18)19/h3-10H,2H2,1H3/q+1/b12-10+