1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[5-(4-tert-butylphenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[5-(4-tert-butylphenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one Formula: C21H31N3O2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C(C)(C)C

Isomeric SMILES

CC(C)COC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C(C)(C)C

InChI

InChI=1S/C21H31N3O2/c1-14(2)13-26-19-22-17(24(23-19)18(25)21(6,7)8)15-9-11-16(12-10-15)20(3,4)5/h9-12,14H,13H2,1-8H3