1,3-diethyl-2-methyl-benzimidazol-1-ium-5-carbonitrile

Systemtic Name: 1,3-diethyl-2-methyl-benzimidazol-1-ium-5-carbonitrile Openeye Name: 1,3-diethyl-2-methyl-benzimidazol-1-ium-5-carbonitrile CAS Name: 1,3-diethyl-2-methyl-5-benzimidazol-1-iumcarbonitrile IUPAC Name: 1,3-diethyl-2-methylbenzimidazol-1-ium-5-carbonitrile Traditional Name: 1,3-diethyl-2-methyl-benzimidazol-1-ium-5-carbonitrile Formula: C13H16N3+ MolecularWeight: 214.28624

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C2=C1C=C(C=C2)C#N)CC)C

Isomeric SMILES

CCN1C(=[N+](C2=C1C=C(C=C2)C#N)CC)C

InChI

InChI=1S/C13H16N3/c1-4-15-10(3)16(5-2)13-8-11(9-14)6-7-12(13)15/h6-8H,4-5H2,1-3H3/q+1