[3-acetyloxy-2-[(6R)-3-(bromomethyl)-6-prop-1-en-2-yl-cyclohex-2-en-1-yl]-5-pentyl-phenyl] ethanoate

Systemtic Name: [3-acetyloxy-2-[(6R)-3-(bromomethyl)-6-prop-1-en-2-yl-cyclohex-2-en-1-yl]-5-pentyl-phenyl] ethanoate Openeye Name: [3-acetoxy-2-[(6R)-3-(bromomethyl)-6-isopropenyl-cyclohex-2-en-1-yl]-5-pentyl-phenyl] acetate CAS Name: acetic acid [3-acetyloxy-2-[(6R)-3-(bromomethyl)-6-(1-methylethenyl)-1-cyclohex-2-enyl]-5-pentylphenyl] ester IUPAC Name: [3-acetyloxy-2-[(6R)-3-(bromomethyl)-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylphenyl] acetate Traditional Name: acetic acid [3-acetoxy-5-amyl-2-[(6R)-3-(bromomethyl)-6-isopropenyl-cyclohex-2-en-1-yl]phenyl] ester Formula: C25H33BrO4 MolecularWeight: 477.43112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1)OC(=O)C)C2C=C(CCC2C(=C)C)CBr)OC(=O)C

Isomeric SMILES

CCCCCC1=CC(=C(C(=C1)OC(=O)C)C2C=C(CC[C@H]2C(=C)C)CBr)OC(=O)C

InChI

InChI=1S/C25H33BrO4/c1-6-7-8-9-19-13-23(29-17(4)27)25(24(14-19)30-18(5)28)22-12-20(15-26)10-11-21(22)16(2)3/h12-14,21-22H,2,6-11,15H2,1,3-5H3/t21-,22?/m0/s1