3-azanylidene-2-(1,3-dimethyl-2H-cyclohepta[d]imidazol-3-ium-2-yl)prop-2-enenitrile

Systemtic Name: 3-azanylidene-2-(1,3-dimethyl-2H-cyclohepta[d]imidazol-3-ium-2-yl)prop-2-enenitrile Openeye Name: 2-(1,3-dimethyl-2H-cyclohepta[d]imidazol-3-ium-2-yl)-3-imino-prop-2-enenitrile CAS Name: 2-(1,3-dimethyl-2H-cyclohepta[d]imidazol-3-ium-2-yl)-3-imino-2-propenenitrile IUPAC Name: 2-(1,3-dimethyl-2H-cyclohepta[d]imidazol-3-ium-2-yl)-3-iminoprop-2-enenitrile Traditional Name: 2-(1,3-dimethyl-2H-cyclohept[d]imidazol-3-ium-2-yl)-3-imino-acrylonitrile Formula: C13H13N4+ MolecularWeight: 225.26912

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Descriptors Computed from Structure

Canonical SMILES:

CN1C([N+](=C2C1=CC=CC=C2)C)C(=C=N)C#N

Isomeric SMILES

CN1C([N+](=C2C1=CC=CC=C2)C)C(=C=N)C#N

InChI

InChI=1S/C13H13N4/c1-16-11-6-4-3-5-7-12(11)17(2)13(16)10(8-14)9-15/h3-7,13-14H,1-2H3/q+1