methyl 5-[6-(6-bromanylhexoxy)hex-1-ynyl]furan-2-carboxylate

Systemtic Name: methyl 5-[6-(6-bromanylhexoxy)hex-1-ynyl]furan-2-carboxylate Openeye Name: methyl 5-[6-(6-bromohexoxy)hex-1-ynyl]furan-2-carboxylate CAS Name: 5-[6-(6-bromohexoxy)hex-1-ynyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[6-(6-bromohexoxy)hex-1-ynyl]furan-2-carboxylate Traditional Name: 5-[6-(6-bromohexoxy)hex-1-ynyl]furan-2-carboxylic acid methyl ester Formula: C18H25BrO4 MolecularWeight: 385.2927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)C#CCCCCOCCCCCCBr

Isomeric SMILES

COC(=O)C1=CC=C(O1)C#CCCCCOCCCCCCBr

InChI

InChI=1S/C18H25BrO4/c1-21-18(20)17-12-11-16(23-17)10-6-2-4-8-14-22-15-9-5-3-7-13-19/h11-12H,2-5,7-9,13-15H2,1H3