2-[4-(2-methylpropyl)phenyl]propanoic acid; tris(phenylmethyl)tin

Systemtic Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid; tris(phenylmethyl)tin Openeye Name: 2-(4-isobutylphenyl)propanoic acid; tribenzyltin CAS Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid; tris(phenylmethyl)tin IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid; tribenzyltin Traditional Name: 2-(4-isobutylphenyl)propionic acid; tribenzyltin Formula: C34H39O2Sn MolecularWeight: 598.38226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.C1=CC=C(C=C1)C[Sn](CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.C1=CC=C(C=C1)C[Sn](CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C13H18O2.3C7H7.Sn/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;3*1-7-5-3-2-4-6-7;/h4-7,9-10H,8H2,1-3H3,(H,14,15);3*2-6H,1H2;