4-cyclohexyl-1-phenyl-1,2,4-triazol-4-ium

Systemtic Name: 4-cyclohexyl-1-phenyl-1,2,4-triazol-4-ium Openeye Name: 4-cyclohexyl-1-phenyl-1,2,4-triazol-4-ium CAS Name: 4-cyclohexyl-1-phenyl-1,2,4-triazol-4-ium IUPAC Name: 4-cyclohexyl-1-phenyl-1,2,4-triazol-4-ium Traditional Name: 4-cyclohexyl-1-phenyl-1,2,4-triazol-4-ium Formula: C14H18N3+ MolecularWeight: 228.31282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[N+]2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)[N+]2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C14H18N3/c1-3-7-13(8-4-1)16-11-15-17(12-16)14-9-5-2-6-10-14/h2,5-6,9-13H,1,3-4,7-8H2/q+1