4-(cyclohexylmethyl)-1-(2,4,6-trimethylphenyl)-1,2,4-triazol-4-ium

Systemtic Name: 4-(cyclohexylmethyl)-1-(2,4,6-trimethylphenyl)-1,2,4-triazol-4-ium Openeye Name: 4-(cyclohexylmethyl)-1-(2,4,6-trimethylphenyl)-1,2,4-triazol-4-ium CAS Name: 4-(cyclohexylmethyl)-1-(2,4,6-trimethylphenyl)-1,2,4-triazol-4-ium IUPAC Name: 4-(cyclohexylmethyl)-1-(2,4,6-trimethylphenyl)-1,2,4-triazol-4-ium Traditional Name: 4-(cyclohexylmethyl)-1-mesityl-1,2,4-triazol-4-ium Formula: C18H26N3+ MolecularWeight: 284.41914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C=[N+](C=N2)CC3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C=[N+](C=N2)CC3CCCCC3)C

InChI

InChI=1S/C18H26N3/c1-14-9-15(2)18(16(3)10-14)21-13-20(12-19-21)11-17-7-5-4-6-8-17/h9-10,12-13,17H,4-8,11H2,1-3H3/q+1