3-bromanyl-1-(2-tert-butyl-6-methoxy-phenyl)propan-1-one

Systemtic Name: 3-bromanyl-1-(2-tert-butyl-6-methoxy-phenyl)propan-1-one Openeye Name: 3-bromo-1-(2-tert-butyl-6-methoxy-phenyl)propan-1-one CAS Name: 3-bromo-1-(2-tert-butyl-6-methoxyphenyl)-1-propanone IUPAC Name: 3-bromo-1-(2-tert-butyl-6-methoxyphenyl)propan-1-one Traditional Name: 3-bromo-1-(2-tert-butyl-6-methoxy-phenyl)propan-1-one Formula: C14H19BrO2 MolecularWeight: 299.20346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC=C1)OC)C(=O)CCBr

Isomeric SMILES

CC(C)(C)C1=C(C(=CC=C1)OC)C(=O)CCBr

InChI

InChI=1S/C14H19BrO2/c1-14(2,3)10-6-5-7-12(17-4)13(10)11(16)8-9-15/h5-7H,8-9H2,1-4H3