dibutyltin(2+); (Z)-2-tridecylbut-2-enedioate

Systemtic Name: dibutyltin(2+); (Z)-2-tridecylbut-2-enedioate Openeye Name: dibutyltin(2+); (Z)-2-tridecylbut-2-enedioate CAS Name: dibutyltin(2+); (Z)-2-tridecyl-2-butenedioate IUPAC Name: dibutyltin(2+); (Z)-2-tridecylbut-2-enedioate Traditional Name: dibutyltin(2+); (Z)-2-tridecylbut-2-enedioate Formula: C50H92O8Sn2 MolecularWeight: 1058.68068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=CC(=O)[O-])C(=O)[O-].CCCCCCCCCCCCCC(=CC(=O)[O-])C(=O)[O-].CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC

Isomeric SMILES

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

InChI

InChI=1S/2C17H30O4.4C4H9.2Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-15(17(20)21)14-16(18)19;4*1-3-4-2;;/h2*14H,2-13H2,1H3,(H,18,19)(H,20,21);4*1,3-4H2,2H3;;/q;;;;;;2*+2/p-4/b2*15-14-;;;;;;