butyl(hexyl)tin(2+); (E)-4-(2,2-dimethyl-1-phenyl-propoxy)-4-oxidanylidene-but-2-enoate

Systemtic Name: butyl(hexyl)tin(2+); (E)-4-(2,2-dimethyl-1-phenyl-propoxy)-4-oxidanylidene-but-2-enoate Openeye Name: butyl(hexyl)tin(2+); (E)-4-(2,2-dimethyl-1-phenyl-propoxy)-4-oxo-but-2-enoate CAS Name: butyl(hexyl)tin(2+); (E)-4-(2,2-dimethyl-1-phenylpropoxy)-4-oxo-2-butenoate IUPAC Name: butyl(hexyl)tin(2+); (E)-4-(2,2-dimethyl-1-phenylpropoxy)-4-oxobut-2-enoate Traditional Name: butyl(hexyl)tin(2+); (E)-4-(2,2-dimethyl-1-phenyl-propoxy)-4-keto-but-2-enoate Formula: C40H56O8Sn MolecularWeight: 783.57784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[Sn+2]CCCC.CC(C)(C)C(C1=CC=CC=C1)OC(=O)C=CC(=O)[O-].CC(C)(C)C(C1=CC=CC=C1)OC(=O)C=CC(=O)[O-]

Isomeric SMILES

CCCCCC[Sn+2]CCCC.CC(C(OC(=O)/C=C/C(=O)[O-])C1=CC=CC=C1)(C)C.CC(C(OC(=O)/C=C/C(=O)[O-])C1=CC=CC=C1)(C)C

InChI

InChI=1S/2C15H18O4.C6H13.C4H9.Sn/c2*1-15(2,3)14(11-7-5-4-6-8-11)19-13(18)10-9-12(16)17;1-3-5-6-4-2;1-3-4-2;/h2*4-10,14H,1-3H3,(H,16,17);1,3-6H2,2H3;1,3-4H2,2H3;/q;;;;+2/p-2/b2*10-9+;;;