dioctyltin; 2-[4-(2-methylpropyl)phenyl]propanoic acid

Systemtic Name: dioctyltin; 2-[4-(2-methylpropyl)phenyl]propanoic acid Openeye Name: dioctyltin; 2-(4-isobutylphenyl)propanoic acid CAS Name: dioctyltin; 2-[4-(2-methylpropyl)phenyl]propanoic acid IUPAC Name: dioctyltin; 2-[4-(2-methylpropyl)phenyl]propanoic acid Traditional Name: dioctyltin; 2-(4-isobutylphenyl)propionic acid Formula: C42H70O4Sn MolecularWeight: 757.7128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn]CCCCCCCC.CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

Isomeric SMILES

CCCCCCCC[Sn]CCCCCCCC.CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

InChI

InChI=1S/2C13H18O2.2C8H17.Sn/c2*1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;2*1-3-5-7-8-6-4-2;/h2*4-7,9-10H,8H2,1-3H3,(H,14,15);2*1,3-8H2,2H3;