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

Systemtic Name: [3-acetyloxy-5-pentyl-2-[(1R,6R)-6-prop-1-en-2-yl-3-trimethylstannyl-cyclohex-3-en-1-yl]phenyl] ethanoate Openeye Name: [3-acetoxy-2-[(1R,6R)-6-isopropenyl-3-trimethylstannyl-cyclohex-3-en-1-yl]-5-pentyl-phenyl] acetate CAS Name: acetic acid [3-acetyloxy-2-[(1R,6R)-6-(1-methylethenyl)-3-trimethylstannyl-1-cyclohex-3-enyl]-5-pentylphenyl] ester IUPAC Name: [3-acetyloxy-5-pentyl-2-[(1R,6R)-6-prop-1-en-2-yl-3-trimethylstannylcyclohex-3-en-1-yl]phenyl] acetate Traditional Name: acetic acid [3-acetoxy-5-amyl-2-[(1R,6R)-6-isopropenyl-3-trimethylstannyl-cyclohex-3-en-1-yl]phenyl] ester Formula: C27H40O4Sn MolecularWeight: 547.3141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1)OC(=O)C)C2CC(=CCC2C(=C)C)[Sn](C)(C)C)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C24H31O4.3CH3.Sn/c1-6-7-8-11-19-14-22(27-17(4)25)24(23(15-19)28-18(5)26)21-13-10-9-12-20(21)16(2)3;;;;/h9,14-15,20-21H,2,6-8,11-13H2,1,3-5H3;3*1H3;/t20-,21+;;;;/m0..../s1