bis(2-ethylhexyl)tin(2+); 2,2-bis(phenylmethyl)hexanedioate

Systemtic Name: bis(2-ethylhexyl)tin(2+); 2,2-bis(phenylmethyl)hexanedioate Openeye Name: bis(2-ethylhexyl)tin(2+); 2,2-dibenzylhexanedioate CAS Name: bis(2-ethylhexyl)tin(2+); 2,2-bis(phenylmethyl)hexanedioate IUPAC Name: bis(2-ethylhexyl)tin(2+); 2,2-dibenzylhexanedioate Traditional Name: bis(2-ethylhexyl)tin(2+); 2,2-dibenzyladipate Formula: C36H54O4Sn MolecularWeight: 669.52156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[Sn+2]CC(CC)CCCC.C1=CC=C(C=C1)CC(CCCC(=O)[O-])(CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CCCCC(CC)C[Sn+2]CC(CC)CCCC.C1=CC=C(C=C1)CC(CCCC(=O)[O-])(CC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C20H22O4.2C8H17.Sn/c21-18(22)12-7-13-20(19(23)24,14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17;2*1-4-6-7-8(3)5-2;/h1-6,8-11H,7,12-15H2,(H,21,22)(H,23,24);2*8H,3-7H2,1-2H3;/q;;;+2/p-2