3-[2-carboxyethylsulfanyl(phenyl)methyl]sulfanylpropanoic acid; dibutyltin

Systemtic Name: 3-[2-carboxyethylsulfanyl(phenyl)methyl]sulfanylpropanoic acid; dibutyltin Openeye Name: 3-[2-carboxyethylsulfanyl(phenyl)methyl]sulfanylpropanoic acid; dibutyltin CAS Name: 3-[[(2-carboxyethylthio)-phenylmethyl]thio]propanoic acid; dibutyltin IUPAC Name: 3-[2-carboxyethylsulfanyl(phenyl)methyl]sulfanylpropanoic acid; dibutyltin Traditional Name: 3-[[(2-carboxyethylthio)-phenyl-methyl]thio]propionic acid; dibutyltin Formula: C21H34O4S2Sn MolecularWeight: 533.33226

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn]CCCC.C1=CC=C(C=C1)C(SCCC(=O)O)SCCC(=O)O

Isomeric SMILES

CCCC[Sn]CCCC.C1=CC=C(C=C1)C(SCCC(=O)O)SCCC(=O)O

InChI

InChI=1S/C13H16O4S2.2C4H9.Sn/c14-11(15)6-8-18-13(19-9-7-12(16)17)10-4-2-1-3-5-10;2*1-3-4-2;/h1-5,13H,6-9H2,(H,14,15)(H,16,17);2*1,3-4H2,2H3;