3-[[3-(2-carboxyethyloxymethoxy)-5-(3-methanoyloxypropanoyloxy)phenoxy]methoxy]propanoic acid

Systemtic Name: 3-[[3-(2-carboxyethyloxymethoxy)-5-(3-methanoyloxypropanoyloxy)phenoxy]methoxy]propanoic acid Openeye Name: 3-[[3-(2-carboxyethyloxymethoxy)-5-(3-formyloxypropanoyloxy)phenoxy]methoxy]propanoic acid CAS Name: 3-[[3-(2-carboxyethyloxymethoxy)-5-(3-formyloxy-1-oxopropoxy)phenoxy]methoxy]propanoic acid IUPAC Name: 3-[[3-(2-carboxyethyloxymethoxy)-5-(3-formyloxypropanoyloxy)phenoxy]methoxy]propanoic acid Traditional Name: 3-[[3-(2-carboxyethyloxymethoxy)-5-(3-formyloxypropanoyloxy)phenoxy]methoxy]propionic acid Formula: C18H22O12 MolecularWeight: 430.36008

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1OCOCCC(=O)O)OC(=O)CCOC=O)OCOCCC(=O)O

Isomeric SMILES

C1=C(C=C(C=C1OCOCCC(=O)O)OC(=O)CCOC=O)OCOCCC(=O)O

InChI

InChI=1S/C18H22O12/c19-10-25-6-3-18(24)30-15-8-13(28-11-26-4-1-16(20)21)7-14(9-15)29-12-27-5-2-17(22)23/h7-10H,1-6,11-12H2,(H,20,21)(H,22,23)