dibutyltin(2+); 2-oxidanyl-2,3-bis(phenylmethyl)butanedioate

Systemtic Name: dibutyltin(2+); 2-oxidanyl-2,3-bis(phenylmethyl)butanedioate Openeye Name: 2,3-dibenzyl-2-hydroxy-butanedioate; dibutyltin(2+) CAS Name: dibutyltin(2+); 2-hydroxy-2,3-bis(phenylmethyl)butanedioate IUPAC Name: 2,3-dibenzyl-2-hydroxybutanedioate; dibutyltin(2+) Traditional Name: 2,3-dibenzyl-2-hydroxy-succinate; dibutyltin(2+) Formula: C26H34O5Sn MolecularWeight: 545.25516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18O5.2C4H9.Sn/c19-16(20)15(11-13-7-3-1-4-8-13)18(23,17(21)22)12-14-9-5-2-6-10-14;2*1-3-4-2;/h1-10,15,23H,11-12H2,(H,19,20)(H,21,22);2*1,3-4H2,2H3;/q;;;+2/p-2