3-ethyl-5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazole hydrochloride

Systemtic Name: 3-ethyl-5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazole hydrochloride Openeye Name: 3-ethyl-5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazole hydrochloride CAS Name: 3-ethyl-5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazole hydrochloride IUPAC Name: 3-ethyl-5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazole hydrochloride Traditional Name: 3-ethyl-5-(4-methoxyphenyl)-4-phenyl-1,2,4-triazole hydrochloride Formula: C17H18ClN3O MolecularWeight: 315.79732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)OC.Cl

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)OC.Cl

InChI

InChI=1S/C17H17N3O.ClH/c1-3-16-18-19-17(13-9-11-15(21-2)12-10-13)20(16)14-7-5-4-6-8-14;/h4-12H,3H2,1-2H3;1H