methyl 4-[(E)-7-bromanyl-4,8-dimethyl-8-oxidanyl-non-3-enyl]-2-methoxy-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 4-[(E)-7-bromanyl-4,8-dimethyl-8-oxidanyl-non-3-enyl]-2-methoxy-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 4-[(E)-7-bromo-8-hydroxy-4,8-dimethyl-non-3-enyl]-2-methoxy-cyclohex-3-ene-1-carboxylate CAS Name: 4-[(E)-7-bromo-8-hydroxy-4,8-dimethylnon-3-enyl]-2-methoxy-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 4-[(E)-7-bromo-8-hydroxy-4,8-dimethylnon-3-enyl]-2-methoxycyclohex-3-ene-1-carboxylate Traditional Name: 4-[(E)-7-bromo-8-hydroxy-4,8-dimethyl-non-3-enyl]-2-methoxy-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C20H33BrO4 MolecularWeight: 417.37762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC1=CC(C(CC1)C(=O)OC)OC)CCC(C(C)(C)O)Br

Isomeric SMILES

C/C(=C\CCC1=CC(C(CC1)C(=O)OC)OC)/CCC(C(C)(C)O)Br

InChI

InChI=1S/C20H33BrO4/c1-14(9-12-18(21)20(2,3)23)7-6-8-15-10-11-16(19(22)25-5)17(13-15)24-4/h7,13,16-18,23H,6,8-12H2,1-5H3/b14-7+