1-[4-bromanyl-2,5-bis(oxidanyl)phenyl]-3,7-dimethyl-3-oxidanyl-oct-6-en-1-one

Systemtic Name: 1-[4-bromanyl-2,5-bis(oxidanyl)phenyl]-3,7-dimethyl-3-oxidanyl-oct-6-en-1-one Openeye Name: 1-(4-bromo-2,5-dihydroxy-phenyl)-3-hydroxy-3,7-dimethyl-oct-6-en-1-one CAS Name: 1-(4-bromo-2,5-dihydroxyphenyl)-3-hydroxy-3,7-dimethyl-6-octen-1-one IUPAC Name: 1-(4-bromo-2,5-dihydroxyphenyl)-3-hydroxy-3,7-dimethyloct-6-en-1-one Traditional Name: 1-(4-bromo-2,5-dihydroxy-phenyl)-3-hydroxy-3,7-dimethyl-oct-6-en-1-one Formula: C16H21BrO4 MolecularWeight: 357.23954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrO4/c1-10(2)5-4-6-16(3,21)9-15(20)11-7-14(19)12(17)8-13(11)18/h5,7-8,18-19,21H,4,6,9H2,1-3H3