4-bromanyl-1-(4-chloranylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one

Systemtic Name: 4-bromanyl-1-(4-chloranylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Openeye Name: 4-bromo-1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one CAS Name: 4-bromo-1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone IUPAC Name: 4-bromo-1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Traditional Name: 4-bromo-1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Formula: C14H15BrClN3O2 MolecularWeight: 372.6448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CBr)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(CBr)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H15BrClN3O2/c1-14(2,7-15)12(20)13(19-9-17-8-18-19)21-11-5-3-10(16)4-6-11/h3-6,8-9,13H,7H2,1-2H3