(E)-6-(5-bromanyl-2,3,4-trimethyl-6-oxidanyl-phenyl)-4-methyl-hex-4-enoic acid

Systemtic Name: (E)-6-(5-bromanyl-2,3,4-trimethyl-6-oxidanyl-phenyl)-4-methyl-hex-4-enoic acid Openeye Name: (E)-6-(3-bromo-2-hydroxy-4,5,6-trimethyl-phenyl)-4-methyl-hex-4-enoic acid CAS Name: (E)-6-(3-bromo-2-hydroxy-4,5,6-trimethylphenyl)-4-methyl-4-hexenoic acid IUPAC Name: (E)-6-(3-bromo-2-hydroxy-4,5,6-trimethylphenyl)-4-methylhex-4-enoic acid Traditional Name: (E)-6-(3-bromo-2-hydroxy-4,5,6-trimethyl-phenyl)-4-methyl-hex-4-enoic acid Formula: C16H21BrO3 MolecularWeight: 341.24014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)Br)O)CC=C(C)CCC(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)Br)O)C/C=C(\C)/CCC(=O)O)C

InChI

InChI=1S/C16H21BrO3/c1-9(6-8-14(18)19)5-7-13-11(3)10(2)12(4)15(17)16(13)20/h5,20H,6-8H2,1-4H3,(H,18,19)/b9-5+