3-(4-butoxyphenyl)-5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(4-butoxyphenyl)-5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-(4-butoxyphenyl)-5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazole CAS Name: 3-(4-butoxyphenyl)-5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazole IUPAC Name: 3-(4-butoxyphenyl)-5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-(4-butoxyphenyl)-5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazole Formula: C28H31N3O MolecularWeight: 425.56524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C28H31N3O/c1-5-6-20-32-25-18-14-22(15-19-25)27-30-29-26(31(27)24-10-8-7-9-11-24)21-12-16-23(17-13-21)28(2,3)4/h7-19H,5-6,20H2,1-4H3