3-(2-chlorophenyl)-5-(2-fluoranyl-5-undecyl-phenyl)-1-methyl-1,2,4-triazole

Systemtic Name: 3-(2-chlorophenyl)-5-(2-fluoranyl-5-undecyl-phenyl)-1-methyl-1,2,4-triazole Openeye Name: 3-(2-chlorophenyl)-5-(2-fluoro-5-undecyl-phenyl)-1-methyl-1,2,4-triazole CAS Name: 3-(2-chlorophenyl)-5-(2-fluoro-5-undecylphenyl)-1-methyl-1,2,4-triazole IUPAC Name: 3-(2-chlorophenyl)-5-(2-fluoro-5-undecylphenyl)-1-methyl-1,2,4-triazole Traditional Name: 3-(2-chlorophenyl)-5-(2-fluoro-5-undecyl-phenyl)-1-methyl-1,2,4-triazole Formula: C26H33ClFN3 MolecularWeight: 442.011723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC(=C(C=C1)F)C2=NC(=NN2C)C3=CC=CC=C3Cl

Isomeric SMILES

CCCCCCCCCCCC1=CC(=C(C=C1)F)C2=NC(=NN2C)C3=CC=CC=C3Cl

InChI

InChI=1S/C26H33ClFN3/c1-3-4-5-6-7-8-9-10-11-14-20-17-18-24(28)22(19-20)26-29-25(30-31(26)2)21-15-12-13-16-23(21)27/h12-13,15-19H,3-11,14H2,1-2H3