1-ethyl-2-(2-methylimidazol-1-yl)-2H-1,3,5-triazin-1-ium-1,4-dicarbonitrile

Systemtic Name: 1-ethyl-2-(2-methylimidazol-1-yl)-2H-1,3,5-triazin-1-ium-1,4-dicarbonitrile Openeye Name: 1-ethyl-2-(2-methylimidazol-1-yl)-2H-1,3,5-triazin-1-ium-1,4-dicarbonitrile CAS Name: 1-ethyl-2-(2-methyl-1-imidazolyl)-2H-1,3,5-triazin-1-ium-1,4-dicarbonitrile IUPAC Name: 1-ethyl-2-(2-methylimidazol-1-yl)-2H-1,3,5-triazin-1-ium-1,4-dicarbonitrile Traditional Name: 1-ethyl-2-(2-methylimidazol-1-yl)-2H-s-triazin-1-ium-1,4-dicarbonitrile Formula: C11H12N7+ MolecularWeight: 242.25988

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=NC(=NC1N2C=CN=C2C)C#N)C#N

Isomeric SMILES

CC[N+]1(C=NC(=NC1N2C=CN=C2C)C#N)C#N

InChI

InChI=1S/C11H12N7/c1-3-18(7-13)8-15-10(6-12)16-11(18)17-5-4-14-9(17)2/h4-5,8,11H,3H2,1-2H3/q+1