(E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-ethoxy-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-ethoxy-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-ethoxy-3-oxo-prop-1-en-1-olate CAS Name: (E)-2-(2,3-dimethyl-1-benzimidazol-3-iumyl)-3-ethoxy-3-oxo-1-propen-1-olate IUPAC Name: (E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-ethoxy-3-oxoprop-1-en-1-olate Traditional Name: (E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-3-ethoxy-3-keto-prop-1-en-1-olate Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C[O-])N1C(=[N+](C2=CC=CC=C21)C)C

Isomeric SMILES

CCOC(=O)/C(=C\[O-])/N1C(=[N+](C2=CC=CC=C21)C)C

InChI

InChI=1S/C14H16N2O3/c1-4-19-14(18)13(9-17)16-10(2)15(3)11-7-5-6-8-12(11)16/h5-9H,4H2,1-3H3