2-(6-azanyl-2,3,7-tricyano-pyrrolo[2,3-b]pyrazin-5-yl)ethyl-dimethyl-azanium

Systemtic Name: 2-(6-azanyl-2,3,7-tricyano-pyrrolo[2,3-b]pyrazin-5-yl)ethyl-dimethyl-azanium Openeye Name: 2-(6-amino-2,3,7-tricyano-pyrrolo[2,3-b]pyrazin-5-yl)ethyl-dimethyl-ammonium CAS Name: 2-(6-amino-2,3,7-tricyano-5-pyrrolo[2,3-b]pyrazinyl)ethyl-dimethylammonium IUPAC Name: 2-(6-amino-2,3,7-tricyanopyrrolo[2,3-b]pyrazin-5-yl)ethyl-dimethylazanium Traditional Name: 2-(6-amino-2,3,7-tricyano-pyrrolo[2,3-b]pyrazin-5-yl)ethyl-dimethyl-ammonium Formula: C13H13N8+ MolecularWeight: 281.29592

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(=C(C2=NC(=C(N=C21)C#N)C#N)C#N)N

Isomeric SMILES

C[NH+](C)CCN1C(=C(C2=NC(=C(N=C21)C#N)C#N)C#N)N

InChI

InChI=1S/C13H12N8/c1-20(2)3-4-21-12(17)8(5-14)11-13(21)19-10(7-16)9(6-15)18-11/h3-4,17H2,1-2H3/p+1