2-(2-bromanyl-4-tert-butyl-phenoxy)-1-(3,4,5-trimethylpyrazol-1-yl)ethanone

Systemtic Name: 2-(2-bromanyl-4-tert-butyl-phenoxy)-1-(3,4,5-trimethylpyrazol-1-yl)ethanone Openeye Name: 2-(2-bromo-4-tert-butyl-phenoxy)-1-(3,4,5-trimethylpyrazol-1-yl)ethanone CAS Name: 2-(2-bromo-4-tert-butylphenoxy)-1-(3,4,5-trimethyl-1-pyrazolyl)ethanone IUPAC Name: 2-(2-bromo-4-tert-butylphenoxy)-1-(3,4,5-trimethylpyrazol-1-yl)ethanone Traditional Name: 2-(2-bromo-4-tert-butyl-phenoxy)-1-(3,4,5-trimethylpyrazol-1-yl)ethanone Formula: C18H23BrN2O2 MolecularWeight: 379.29142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C)C(=O)COC2=C(C=C(C=C2)C(C)(C)C)Br)C

Isomeric SMILES

CC1=C(N(N=C1C)C(=O)COC2=C(C=C(C=C2)C(C)(C)C)Br)C

InChI

InChI=1S/C18H23BrN2O2/c1-11-12(2)20-21(13(11)3)17(22)10-23-16-8-7-14(9-15(16)19)18(4,5)6/h7-9H,10H2,1-6H3