(4S)-5-methoxy-5-oxidanylidene-4-(phenylcarbonyloxy)pentanoic acid

Systemtic Name: (4S)-5-methoxy-5-oxidanylidene-4-(phenylcarbonyloxy)pentanoic acid Openeye Name: (4S)-4-benzoyloxy-5-methoxy-5-oxo-pentanoic acid CAS Name: (4S)-4-benzoyloxy-5-methoxy-5-oxopentanoic acid IUPAC Name: (4S)-4-benzoyloxy-5-methoxy-5-oxopentanoic acid Traditional Name: (4S)-4-benzoyloxy-5-keto-5-methoxy-valeric acid Formula: C13H14O6 MolecularWeight: 266.24666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(=O)O)OC(=O)C1=CC=CC=C1

Isomeric SMILES

COC(=O)[C@H](CCC(=O)O)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H14O6/c1-18-13(17)10(7-8-11(14)15)19-12(16)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,14,15)/t10-/m0/s1