12-[(Z)-3-tributylstannylprop-2-enoyl]oxyoctadecanoic acid

Systemtic Name: 12-[(Z)-3-tributylstannylprop-2-enoyl]oxyoctadecanoic acid Openeye Name: 12-[(Z)-3-tributylstannylprop-2-enoyl]oxyoctadecanoic acid CAS Name: 12-[(Z)-1-oxo-3-tributylstannylprop-2-enoxy]octadecanoic acid IUPAC Name: 12-[(Z)-3-tributylstannylprop-2-enoyl]oxyoctadecanoic acid Traditional Name: 12-[(Z)-3-tributylstannylacryloyl]oxystearic acid Formula: C33H64O4Sn MolecularWeight: 643.56886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCCCCCCC(=O)O)OC(=O)C=C[Sn](CCCC)(CCCC)CCCC

Isomeric SMILES

CCCCCCC(CCCCCCCCCCC(=O)O)OC(=O)/C=C\[Sn](CCCC)(CCCC)CCCC

InChI

InChI=1S/C21H37O4.3C4H9.Sn/c1-3-5-6-13-16-19(25-21(24)4-2)17-14-11-9-7-8-10-12-15-18-20(22)23;3*1-3-4-2;/h2,4,19H,3,5-18H2,1H3,(H,22,23);3*1,3-4H2,2H3;