2-[(2S)-5-azanyl-2-pentan-3-yl-2H-imidazol-1-ium-4-yl]propanedinitrile

Systemtic Name: 2-[(2S)-5-azanyl-2-pentan-3-yl-2H-imidazol-1-ium-4-yl]propanedinitrile Openeye Name: 2-[(2S)-5-amino-2-(1-ethylpropyl)-2H-imidazol-1-ium-4-yl]propanedinitrile CAS Name: 2-[(2S)-5-amino-2-pentan-3-yl-2H-imidazol-1-ium-4-yl]propanedinitrile IUPAC Name: 2-[(2S)-5-amino-2-pentan-3-yl-2H-imidazol-1-ium-4-yl]propanedinitrile Traditional Name: 2-[(2S)-5-amino-2-(1-ethylpropyl)-2H-imidazol-1-ium-4-yl]malononitrile Formula: C11H16N5+ MolecularWeight: 218.27824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1[NH+]=C(C(=N1)C(C#N)C#N)N

Isomeric SMILES

CCC(CC)[C@@H]1[NH+]=C(C(=N1)C(C#N)C#N)N

InChI

InChI=1S/C11H15N5/c1-3-7(4-2)11-15-9(10(14)16-11)8(5-12)6-13/h7-8,11H,3-4H2,1-2H3,(H2,14,16)/p+1/t11-/m0/s1