methyl 7-[(3S)-3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl]heptanoate

Systemtic Name: methyl 7-[(3S)-3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl]heptanoate Openeye Name: methyl 7-[(3S)-3-hydroxy-5-oxo-cyclopenten-1-yl]heptanoate CAS Name: 7-[(3S)-3-hydroxy-5-oxo-1-cyclopentenyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[(3S)-3-hydroxy-5-oxocyclopenten-1-yl]heptanoate Traditional Name: 7-[(3S)-3-hydroxy-5-keto-cyclopenten-1-yl]enanthic acid methyl ester Formula: C13H20O4 MolecularWeight: 240.2955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC1=CC(CC1=O)O

Isomeric SMILES

COC(=O)CCCCCCC1=C[C@H](CC1=O)O

InChI

InChI=1S/C13H20O4/c1-17-13(16)7-5-3-2-4-6-10-8-11(14)9-12(10)15/h8,11,14H,2-7,9H2,1H3/t11-/m1/s1