2-methyloct-4-yn-3-yl (E)-3-tributylstannylhex-2-enoate

Systemtic Name: 2-methyloct-4-yn-3-yl (E)-3-tributylstannylhex-2-enoate Openeye Name: 1-isopropylhex-2-ynyl (E)-3-tributylstannylhex-2-enoate CAS Name: (E)-3-tributylstannyl-2-hexenoic acid 2-methyloct-4-yn-3-yl ester IUPAC Name: 2-methyloct-4-yn-3-yl (E)-3-tributylstannylhex-2-enoate Traditional Name: (E)-3-tributylstannylhex-2-enoic acid 1-isopropylhex-2-ynyl ester Formula: C27H50O2Sn MolecularWeight: 525.3947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)C(=CC(=O)OC(C#CCCC)C(C)C)CCC

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)/C(=C/C(=O)OC(C#CCCC)C(C)C)/CCC

InChI

InChI=1S/C15H23O2.3C4H9.Sn/c1-5-7-9-11-14(13(3)4)17-15(16)12-10-8-6-2;3*1-3-4-2;/h12-14H,5-8H2,1-4H3;3*1,3-4H2,2H3;