dioctyltin(2+); (Z)-2-octylbut-2-enedioate

Systemtic Name: dioctyltin(2+); (Z)-2-octylbut-2-enedioate Openeye Name: dioctyltin(2+); (Z)-2-octylbut-2-enedioate CAS Name: dioctyltin(2+); (Z)-2-octyl-2-butenedioate IUPAC Name: dioctyltin(2+); (Z)-2-octylbut-2-enedioate Traditional Name: dioctyltin(2+); (Z)-2-octylbut-2-enedioate Formula: C40H70O8Sn-2 MolecularWeight: 797.689

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=CC(=O)[O-])C(=O)[O-].CCCCCCCCC(=CC(=O)[O-])C(=O)[O-].CCCCCCCC[Sn+2]CCCCCCCC

Isomeric SMILES

CCCCCCCC/C(=C/C(=O)[O-])/C(=O)[O-].CCCCCCCC/C(=C/C(=O)[O-])/C(=O)[O-].CCCCCCCC[Sn+2]CCCCCCCC

InChI

InChI=1S/2C12H20O4.2C8H17.Sn/c2*1-2-3-4-5-6-7-8-10(12(15)16)9-11(13)14;2*1-3-5-7-8-6-4-2;/h2*9H,2-8H2,1H3,(H,13,14)(H,15,16);2*1,3-8H2,2H3;/q;;;;+2/p-4/b2*10-9-;;;