dibutyltin(2+); methyl 3-phenyl-3-sulfanyl-propanoate

Systemtic Name: dibutyltin(2+); methyl 3-phenyl-3-sulfanyl-propanoate Openeye Name: dibutyltin(2+); methyl 3-phenyl-3-sulfanyl-propanoate CAS Name: dibutyltin(2+); 3-mercapto-3-phenylpropanoic acid methyl ester IUPAC Name: dibutyltin(2+); methyl 3-phenyl-3-sulfanylpropanoate Traditional Name: dibutyltin(2+); 3-mercapto-3-phenyl-propionic acid methyl ester Formula: C28H42O4S2Sn+2 MolecularWeight: 625.47068

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+2]CCCC.COC(=O)CC(C1=CC=CC=C1)S.COC(=O)CC(C1=CC=CC=C1)S

Isomeric SMILES

CCCC[Sn+2]CCCC.COC(=O)CC(C1=CC=CC=C1)S.COC(=O)CC(C1=CC=CC=C1)S

InChI

InChI=1S/2C10H12O2S.2C4H9.Sn/c2*1-12-10(11)7-9(13)8-5-3-2-4-6-8;2*1-3-4-2;/h2*2-6,9,13H,7H2,1H3;2*1,3-4H2,2H3;/q;;;;+2