1,4-dioctyl-1,2,4-triazol-4-ium

Systemtic Name: 1,4-dioctyl-1,2,4-triazol-4-ium Openeye Name: 1,4-dioctyl-1,2,4-triazol-4-ium CAS Name: 1,4-dioctyl-1,2,4-triazol-4-ium IUPAC Name: 1,4-dioctyl-1,2,4-triazol-4-ium Traditional Name: 1,4-dioctyl-1,2,4-triazol-4-ium Formula: C18H36N3+ MolecularWeight: 294.49854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=[N+](C=N1)CCCCCCCC

Isomeric SMILES

CCCCCCCCN1C=[N+](C=N1)CCCCCCCC

InChI

InChI=1S/C18H36N3/c1-3-5-7-9-11-13-15-20-17-19-21(18-20)16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3/q+1