octyltin(3+); 2-sulfanyltetradecanoate

Systemtic Name: octyltin(3+); 2-sulfanyltetradecanoate Openeye Name: octyltin(3+); 2-sulfanyltetradecanoate CAS Name: 2-mercaptotetradecanoate; octyltin(3+) IUPAC Name: octyltin(3+); 2-sulfanyltetradecanoate Traditional Name: 2-mercaptomyristate; octyltin(3+) Formula: C50H98O6S3Sn MolecularWeight: 1010.21452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)[O-])S.CCCCCCCCCCCCC(C(=O)[O-])S.CCCCCCCCCCCCC(C(=O)[O-])S.CCCCCCCC[Sn+3]

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)[O-])S.CCCCCCCCCCCCC(C(=O)[O-])S.CCCCCCCCCCCCC(C(=O)[O-])S.CCCCCCCC[Sn+3]

InChI

InChI=1S/3C14H28O2S.C8H17.Sn/c3*1-2-3-4-5-6-7-8-9-10-11-12-13(17)14(15)16;1-3-5-7-8-6-4-2;/h3*13,17H,2-12H2,1H3,(H,15,16);1,3-8H2,2H3;/q;;;;+3/p-3