dibutyltin; 3-(4-methylphenyl)-3-tris(4-methylphenyl)germyl-propanoic acid

Systemtic Name: dibutyltin; 3-(4-methylphenyl)-3-tris(4-methylphenyl)germyl-propanoic acid Openeye Name: dibutyltin; 3-(p-tolyl)-3-(tris-p-tolylgermyl)propanoic acid CAS Name: dibutyltin; 3-(4-methylphenyl)-3-tris(4-methylphenyl)germylpropanoic acid IUPAC Name: dibutyltin; 3-(4-methylphenyl)-3-tris(4-methylphenyl)germylpropanoic acid Traditional Name: dibutyltin; 3-(p-tolyl)-3-(tris-p-tolylgermyl)propionic acid Formula: C70H82Ge2O4Sn MolecularWeight: 1251.38768

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn]CCCC.CC1=CC=C(C=C1)C(CC(=O)O)[Ge](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.CC1=CC=C(C=C1)C(CC(=O)O)[Ge](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C

Isomeric SMILES

CCCC[Sn]CCCC.CC1=CC=C(C=C1)C(CC(=O)O)[Ge](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.CC1=CC=C(C=C1)C(CC(=O)O)[Ge](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C

InChI

InChI=1S/2C31H32GeO2.2C4H9.Sn/c2*1-22-5-13-26(14-6-22)30(21-31(33)34)32(27-15-7-23(2)8-16-27,28-17-9-24(3)10-18-28)29-19-11-25(4)12-20-29;2*1-3-4-2;/h2*5-20,30H,21H2,1-4H3,(H,33,34);2*1,3-4H2,2H3;