5-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-1,2,4-triazole

Systemtic Name: 5-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-1,2,4-triazole Openeye Name: 5-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-1,2,4-triazole CAS Name: 5-[(3-butyl-1-imidazol-1-iumyl)methyl]-1H-1,2,4-triazole IUPAC Name: 5-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-1,2,4-triazole Traditional Name: 5-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-1,2,4-triazole Formula: C10H16N5+ MolecularWeight: 206.26754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1)CC2=NC=NN2

Isomeric SMILES

CCCCN1C=C[N+](=C1)CC2=NC=NN2

InChI

InChI=1S/C10H16N5/c1-2-3-4-14-5-6-15(9-14)7-10-11-8-12-13-10/h5-6,8-9H,2-4,7H2,1H3,(H,11,12,13)/q+1