2-ethanoyl-4-oxidanylidene-3-phenyl-butanoic acid; tributyltin

Systemtic Name: 2-ethanoyl-4-oxidanylidene-3-phenyl-butanoic acid; tributyltin Openeye Name: 2-acetyl-4-oxo-3-phenyl-butanoic acid; tributyltin CAS Name: 2-acetyl-4-oxo-3-phenylbutanoic acid; tributyltin IUPAC Name: 2-acetyl-4-oxo-3-phenylbutanoic acid; tributyltin Traditional Name: 2-acetyl-4-keto-3-phenyl-butyric acid; tributyltin Formula: C24H39O4Sn MolecularWeight: 510.27406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12O4.3C4H9.Sn/c1-8(14)11(12(15)16)10(7-13)9-5-3-2-4-6-9;3*1-3-4-2;/h2-7,10-11H,1H3,(H,15,16);3*1,3-4H2,2H3;