3-(6-methylheptylsulfanyl)propanoate; methyltin(3+)

Systemtic Name: 3-(6-methylheptylsulfanyl)propanoate; methyltin(3+) Openeye Name: 3-(6-methylheptylsulfanyl)propanoate; methyltin(3+) CAS Name: 3-(6-methylheptylthio)propanoate; methyltin(3+) IUPAC Name: 3-(6-methylheptylsulfanyl)propanoate; methyltin(3+) Traditional Name: 3-(6-methylheptylthio)propionate; methyltin(3+) Formula: C34H66O6S3Sn MolecularWeight: 785.78924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCSCCC(=O)[O-].CC(C)CCCCCSCCC(=O)[O-].CC(C)CCCCCSCCC(=O)[O-].C[Sn+3]

Isomeric SMILES

CC(C)CCCCCSCCC(=O)[O-].CC(C)CCCCCSCCC(=O)[O-].CC(C)CCCCCSCCC(=O)[O-].C[Sn+3]

InChI

InChI=1S/3C11H22O2S.CH3.Sn/c3*1-10(2)6-4-3-5-8-14-9-7-11(12)13;;/h3*10H,3-9H2,1-2H3,(H,12,13);1H3;/q;;;;+3/p-3