butyltin; (Z)-4-octoxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: butyltin; (Z)-4-octoxy-4-oxidanylidene-but-2-enoic acid Openeye Name: butyltin; (Z)-4-octoxy-4-oxo-but-2-enoic acid CAS Name: butyltin; (Z)-4-octoxy-4-oxo-2-butenoic acid IUPAC Name: butyltin; (Z)-4-octoxy-4-oxobut-2-enoic acid Traditional Name: butyltin; (Z)-4-keto-4-octoxy-but-2-enoic acid Formula: C40H69O12Sn MolecularWeight: 860.67866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C=CC(=O)O.CCCCCCCCOC(=O)C=CC(=O)O.CCCCCCCCOC(=O)C=CC(=O)O.CCCC[Sn]

Isomeric SMILES

CCCCCCCCOC(=O)/C=C\C(=O)O.CCCCCCCCOC(=O)/C=C\C(=O)O.CCCCCCCCOC(=O)/C=C\C(=O)O.CCCC[Sn]

InChI

InChI=1S/3C12H20O4.C4H9.Sn/c3*1-2-3-4-5-6-7-10-16-12(15)9-8-11(13)14;1-3-4-2;/h3*8-9H,2-7,10H2,1H3,(H,13,14);1,3-4H2,2H3;/b3*9-8-;;