(E,3E)-2-cyano-1-ethoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-prop-1-en-1-olate

Systemtic Name: (E,3E)-2-cyano-1-ethoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-prop-1-en-1-olate Openeye Name: (E,3E)-2-cyano-1-ethoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-prop-1-en-1-olate CAS Name: (E,3E)-2-cyano-1-ethoxy-3-[(3-methyl-1-benzimidazol-3-iumyl)imino]-1-propen-1-olate IUPAC Name: (E,3E)-2-cyano-1-ethoxy-3-(3-methylbenzimidazol-3-ium-1-yl)iminoprop-1-en-1-olate Traditional Name: (E,3E)-2-cyano-1-ethoxy-3-(3-methylbenzimidazol-3-ium-1-yl)imino-prop-1-en-1-olate Formula: C14H14N4O2 MolecularWeight: 270.28656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C=NN1C=[N+](C2=CC=CC=C21)C)C#N)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H14N4O2/c1-3-20-14(19)11(8-15)9-16-18-10-17(2)12-6-4-5-7-13(12)18/h4-7,9-10H,3H2,1-2H3