[(4E)-2-bromanyl-3-methyl-5-oxidanylidene-4-(3-oxidanylpropylidene)cyclopenten-1-yl] butanoate

Systemtic Name: [(4E)-2-bromanyl-3-methyl-5-oxidanylidene-4-(3-oxidanylpropylidene)cyclopenten-1-yl] butanoate Openeye Name: [(4E)-2-bromo-4-(3-hydroxypropylidene)-3-methyl-5-oxo-cyclopenten-1-yl] butanoate CAS Name: butanoic acid [(4E)-2-bromo-4-(3-hydroxypropylidene)-3-methyl-5-oxo-1-cyclopentenyl] ester IUPAC Name: [(4E)-2-bromo-4-(3-hydroxypropylidene)-3-methyl-5-oxocyclopenten-1-yl] butanoate Traditional Name: butyric acid [(4E)-2-bromo-4-(3-hydroxypropylidene)-5-keto-3-methyl-cyclopenten-1-yl] ester Formula: C13H17BrO4 MolecularWeight: 317.17568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C(C(=CCCO)C1=O)C)Br

Isomeric SMILES

CCCC(=O)OC1=C(C(/C(=C\CCO)/C1=O)C)Br

InChI

InChI=1S/C13H17BrO4/c1-3-5-10(16)18-13-11(14)8(2)9(12(13)17)6-4-7-15/h6,8,15H,3-5,7H2,1-2H3/b9-6+