3-[3-(2-carboxyethyl)-2-(5-oxidanylpentoxy)phenyl]propanoic acid

Systemtic Name: 3-[3-(2-carboxyethyl)-2-(5-oxidanylpentoxy)phenyl]propanoic acid Openeye Name: 3-[3-(2-carboxyethyl)-2-(5-hydroxypentoxy)phenyl]propanoic acid CAS Name: 3-[3-(2-carboxyethyl)-2-(5-hydroxypentoxy)phenyl]propanoic acid IUPAC Name: 3-[3-(2-carboxyethyl)-2-(5-hydroxypentoxy)phenyl]propanoic acid Traditional Name: 3-[3-(2-carboxyethyl)-2-(5-hydroxypentoxy)phenyl]propionic acid Formula: C17H24O6 MolecularWeight: 324.36886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CCC(=O)O)OCCCCCO)CCC(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)CCC(=O)O)OCCCCCO)CCC(=O)O

InChI

InChI=1S/C17H24O6/c18-11-2-1-3-12-23-17-13(7-9-15(19)20)5-4-6-14(17)8-10-16(21)22/h4-6,18H,1-3,7-12H2,(H,19,20)(H,21,22)