3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]phenol

Systemtic Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]phenol Openeye Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]phenol CAS Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]phenol IUPAC Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]phenol Traditional Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]phenol Formula: C18H19N3O MolecularWeight: 293.36296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)C3=CC(=CC=C3)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)C3=CC(=CC=C3)O

InChI

InChI=1S/C18H19N3O/c1-18(2,3)14-9-7-12(8-10-14)16-19-17(21-20-16)13-5-4-6-15(22)11-13/h4-11,22H,1-3H3,(H,19,20,21)