4-[3,5-bis(2-carboxyethyloxymethoxy)phenoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3,5-bis(2-carboxyethyloxymethoxy)phenoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3,5-bis(2-carboxyethyloxymethoxy)phenoxy]-4-oxo-butanoic acid CAS Name: 4-[3,5-bis(2-carboxyethyloxymethoxy)phenoxy]-4-oxobutanoic acid IUPAC Name: 4-[3,5-bis(2-carboxyethyloxymethoxy)phenoxy]-4-oxobutanoic acid Traditional Name: 4-[3,5-bis(2-carboxyethyloxymethoxy)phenoxy]-4-keto-butyric 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)CCC(=O)O)OCOCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H22O12/c19-15(20)1-2-18(25)30-14-8-12(28-10-26-5-3-16(21)22)7-13(9-14)29-11-27-6-4-17(23)24/h7-9H,1-6,10-11H2,(H,19,20)(H,21,22)(H,23,24)