3-[3-(2-carboxyethyl)-4-(5-oxidanylpentoxy)phenyl]propanoic acid

Systemtic Name: 3-[3-(2-carboxyethyl)-4-(5-oxidanylpentoxy)phenyl]propanoic acid Openeye Name: 3-[3-(2-carboxyethyl)-4-(5-hydroxypentoxy)phenyl]propanoic acid CAS Name: 3-[3-(2-carboxyethyl)-4-(5-hydroxypentoxy)phenyl]propanoic acid IUPAC Name: 3-[3-(2-carboxyethyl)-4-(5-hydroxypentoxy)phenyl]propanoic acid Traditional Name: 3-[3-(2-carboxyethyl)-4-(5-hydroxypentoxy)phenyl]propionic acid Formula: C17H24O6 MolecularWeight: 324.36886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC(=O)O)CCC(=O)O)OCCCCCO

Isomeric SMILES

C1=CC(=C(C=C1CCC(=O)O)CCC(=O)O)OCCCCCO

InChI

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