[(E)-10-methyl-10-oxidanyl-12-tributylstannyl-dodec-11-enyl] 2-iodanylbenzoate

Systemtic Name: [(E)-10-methyl-10-oxidanyl-12-tributylstannyl-dodec-11-enyl] 2-iodanylbenzoate Openeye Name: [(E)-10-hydroxy-10-methyl-12-tributylstannyl-dodec-11-enyl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [(E)-10-hydroxy-10-methyl-12-tributylstannyldodec-11-enyl] ester IUPAC Name: [(E)-10-hydroxy-10-methyl-12-tributylstannyldodec-11-enyl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [(E)-10-hydroxy-10-methyl-12-tributylstannyl-dodec-11-enyl] ester Formula: C32H55IO3Sn MolecularWeight: 733.39177

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)C=CC(C)(CCCCCCCCCOC(=O)C1=CC=CC=C1I)O

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)/C=C/C(C)(CCCCCCCCCOC(=O)C1=CC=CC=C1I)O

InChI

InChI=1S/C20H28IO3.3C4H9.Sn/c1-3-20(2,23)15-11-7-5-4-6-8-12-16-24-19(22)17-13-9-10-14-18(17)21;3*1-3-4-2;/h1,3,9-10,13-14,23H,4-8,11-12,15-16H2,2H3;3*1,3-4H2,2H3;