bis(3-methoxy-3-oxidanylidene-propyl)tin(2+); 4-ethyl-2-sulfanyl-octanoate

Systemtic Name: bis(3-methoxy-3-oxidanylidene-propyl)tin(2+); 4-ethyl-2-sulfanyl-octanoate Openeye Name: bis(3-methoxy-3-oxo-propyl)tin(2+); 4-ethyl-2-sulfanyl-octanoate CAS Name: bis(3-methoxy-3-oxopropyl)tin(2+); 4-ethyl-2-mercaptooctanoate IUPAC Name: bis(3-methoxy-3-oxopropyl)tin(2+); 4-ethyl-2-sulfanyloctanoate Traditional Name: bis(3-keto-3-methoxy-propyl)tin(2+); 4-ethyl-2-mercapto-caprylate Formula: C28H52O8S2Sn MolecularWeight: 699.54768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(C(=O)[O-])S.CCCCC(CC)CC(C(=O)[O-])S.COC(=O)CC[Sn+2]CCC(=O)OC

Isomeric SMILES

CCCCC(CC)CC(C(=O)[O-])S.CCCCC(CC)CC(C(=O)[O-])S.COC(=O)CC[Sn+2]CCC(=O)OC

InChI

InChI=1S/2C10H20O2S.2C4H7O2.Sn/c2*1-3-5-6-8(4-2)7-9(13)10(11)12;2*1-3-4(5)6-2;/h2*8-9,13H,3-7H2,1-2H3,(H,11,12);2*1,3H2,2H3;/q;;;;+2/p-2