1-[4-bromanyl-2,5-bis(oxidanyl)phenyl]-3,7-dimethyl-3,7-bis(oxidanyl)octan-1-one

Systemtic Name: 1-[4-bromanyl-2,5-bis(oxidanyl)phenyl]-3,7-dimethyl-3,7-bis(oxidanyl)octan-1-one Openeye Name: 1-(4-bromo-2,5-dihydroxy-phenyl)-3,7-dihydroxy-3,7-dimethyl-octan-1-one CAS Name: 1-(4-bromo-2,5-dihydroxyphenyl)-3,7-dihydroxy-3,7-dimethyl-1-octanone IUPAC Name: 1-(4-bromo-2,5-dihydroxyphenyl)-3,7-dihydroxy-3,7-dimethyloctan-1-one Traditional Name: 1-(4-bromo-2,5-dihydroxy-phenyl)-3,7-dihydroxy-3,7-dimethyl-octan-1-one Formula: C16H23BrO5 MolecularWeight: 375.25482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(C)(CC(=O)C1=CC(=C(C=C1O)Br)O)O)O

Isomeric SMILES

CC(C)(CCCC(C)(CC(=O)C1=CC(=C(C=C1O)Br)O)O)O

InChI

InChI=1S/C16H23BrO5/c1-15(2,21)5-4-6-16(3,22)9-14(20)10-7-13(19)11(17)8-12(10)18/h7-8,18-19,21-22H,4-6,9H2,1-3H3