4-[3-(2-methylphenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3-(2-methylphenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-hydroxy-3-(2-methylphenoxy)propoxy]-4-oxo-butanoic acid CAS Name: 4-[2-hydroxy-3-(2-methylphenoxy)propoxy]-4-oxobutanoic acid IUPAC Name: 4-[2-hydroxy-3-(2-methylphenoxy)propoxy]-4-oxobutanoic acid Traditional Name: 4-[2-hydroxy-3-(2-methylphenoxy)propoxy]-4-keto-butyric acid Formula: C14H18O6 MolecularWeight: 282.28912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(COC(=O)CCC(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1OCC(COC(=O)CCC(=O)O)O

InChI

InChI=1S/C14H18O6/c1-10-4-2-3-5-12(10)19-8-11(15)9-20-14(18)7-6-13(16)17/h2-5,11,15H,6-9H2,1H3,(H,16,17)