bis(2-ethylhexyl)tin(2+); (Z)-2,3-dioctylbut-2-enedioate

Systemtic Name: bis(2-ethylhexyl)tin(2+); (Z)-2,3-dioctylbut-2-enedioate Openeye Name: bis(2-ethylhexyl)tin(2+); (Z)-2,3-dioctylbut-2-enedioate CAS Name: bis(2-ethylhexyl)tin(2+); (Z)-2,3-dioctyl-2-butenedioate IUPAC Name: bis(2-ethylhexyl)tin(2+); (Z)-2,3-dioctylbut-2-enedioate Traditional Name: bis(2-ethylhexyl)tin(2+); (Z)-2,3-dioctylbut-2-enedioate Formula: C36H68O4Sn MolecularWeight: 683.63272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCC/C(=C(\CCCCCCCC)/C(=O)[O-])/C(=O)[O-].CCCCC(CC)C[Sn+2]CC(CC)CCCC

InChI

InChI=1S/C20H36O4.2C8H17.Sn/c1-3-5-7-9-11-13-15-17(19(21)22)18(20(23)24)16-14-12-10-8-6-4-2;2*1-4-6-7-8(3)5-2;/h3-16H2,1-2H3,(H,21,22)(H,23,24);2*8H,3-7H2,1-2H3;/q;;;+2/p-2/b18-17-;;;