(Z)-3-butoxycarbonylhept-2-enoic acid; (Z)-4-butoxy-4-oxidanylidene-but-2-enoic acid; butyltin

Systemtic Name: (Z)-3-butoxycarbonylhept-2-enoic acid; (Z)-4-butoxy-4-oxidanylidene-but-2-enoic acid; butyltin Openeye Name: (Z)-3-butoxycarbonylhept-2-enoic acid; (Z)-4-butoxy-4-oxo-but-2-enoic acid; butyltin CAS Name: (Z)-4-butoxy-4-oxo-2-butenoic acid; (Z)-3-[butoxy(oxo)methyl]-2-heptenoic acid; butyltin IUPAC Name: (Z)-3-butoxycarbonylhept-2-enoic acid; (Z)-4-butoxy-4-oxobut-2-enoic acid; butyltin Traditional Name: (Z)-3-butoxycarbonylhept-2-enoic acid; (Z)-4-butoxy-4-keto-but-2-enoic acid; butyltin Formula: C32H53O12Sn MolecularWeight: 748.46602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC(=O)O)C(=O)OCCCC.CCCCOC(=O)C=CC(=O)O.CCCCOC(=O)C=CC(=O)O.CCCC[Sn]

Isomeric SMILES

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

InChI

InChI=1S/C12H20O4.2C8H12O4.C4H9.Sn/c1-3-5-7-10(9-11(13)14)12(15)16-8-6-4-2;2*1-2-3-6-12-8(11)5-4-7(9)10;1-3-4-2;/h9H,3-8H2,1-2H3,(H,13,14);2*4-5H,2-3,6H2,1H3,(H,9,10);1,3-4H2,2H3;/b10-9-;2*5-4-;;