ethyl 2-cyano-3-[(3-methylbenzimidazol-3-ium-1-yl)amino]prop-2-enoate

Systemtic Name: ethyl 2-cyano-3-[(3-methylbenzimidazol-3-ium-1-yl)amino]prop-2-enoate Openeye Name: ethyl 2-cyano-3-[(3-methylbenzimidazol-3-ium-1-yl)amino]prop-2-enoate CAS Name: 2-cyano-3-[(3-methyl-1-benzimidazol-3-iumyl)amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-[(3-methylbenzimidazol-3-ium-1-yl)amino]prop-2-enoate Traditional Name: 2-cyano-3-[(3-methylbenzimidazol-3-ium-1-yl)amino]acrylic acid ethyl ester Formula: C14H15N4O2+ MolecularWeight: 271.2945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNN1C=[N+](C2=CC=CC=C21)C)C#N

Isomeric SMILES

CCOC(=O)C(=CNN1C=[N+](C2=CC=CC=C21)C)C#N

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/p+1