(E)-4-(2-ethylhexoxy)-4-oxidanylidene-but-2-enoate; octyltin(3+)

Systemtic Name: (E)-4-(2-ethylhexoxy)-4-oxidanylidene-but-2-enoate; octyltin(3+) Openeye Name: (E)-4-(2-ethylhexoxy)-4-oxo-but-2-enoate; octyltin(3+) CAS Name: (E)-4-(2-ethylhexoxy)-4-oxo-2-butenoate; octyltin(3+) IUPAC Name: (E)-4-(2-ethylhexoxy)-4-oxobut-2-enoate; octyltin(3+) Traditional Name: (E)-4-(2-ethylhexoxy)-4-keto-but-2-enoate; octyltin(3+) Formula: C32H55O8Sn+ MolecularWeight: 686.4843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn+3].CCCCC(CC)COC(=O)C=CC(=O)[O-].CCCCC(CC)COC(=O)C=CC(=O)[O-]

Isomeric SMILES

CCCCCCCC[Sn+3].CCCCC(COC(=O)/C=C/C(=O)[O-])CC.CCCCC(COC(=O)/C=C/C(=O)[O-])CC

InChI

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