(3-methoxy-3-oxidanylidene-propyl)tin(3+); 2-sulfanylhexanoate

Systemtic Name: (3-methoxy-3-oxidanylidene-propyl)tin(3+); 2-sulfanylhexanoate Openeye Name: (3-methoxy-3-oxo-propyl)tin(3+); 2-sulfanylhexanoate CAS Name: 2-mercaptohexanoate; (3-methoxy-3-oxopropyl)tin(3+) IUPAC Name: (3-methoxy-3-oxopropyl)tin(3+); 2-sulfanylhexanoate Traditional Name: (3-keto-3-methoxy-propyl)tin(3+); 2-mercaptohexanoate Formula: C22H40O8S3Sn MolecularWeight: 647.4532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])S.CCCCC(C(=O)[O-])S.CCCCC(C(=O)[O-])S.COC(=O)CC[Sn+3]

Isomeric SMILES

CCCCC(C(=O)[O-])S.CCCCC(C(=O)[O-])S.CCCCC(C(=O)[O-])S.COC(=O)CC[Sn+3]

InChI

InChI=1S/3C6H12O2S.C4H7O2.Sn/c3*1-2-3-4-5(9)6(7)8;1-3-4(5)6-2;/h3*5,9H,2-4H2,1H3,(H,7,8);1,3H2,2H3;/q;;;;+3/p-3