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

Systemtic Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[5-(4-tert-butylphenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-3,3-dimethylbutan-1-one Traditional Name: 1-[5-(4-tert-butylphenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one Formula: C22H33N3O2 MolecularWeight: 371.51632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N3O2/c1-15(2)14-27-20-23-19(25(24-20)18(26)13-21(3,4)5)16-9-11-17(12-10-16)22(6,7)8/h9-12,15H,13-14H2,1-8H3