3-[7-oxidanyl-2-(2-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-6-yl]propanoic acid

Systemtic Name: 3-[7-oxidanyl-2-(2-oxidanylpropan-2-yl)-2,3-dihydro-1-benzofuran-6-yl]propanoic acid Openeye Name: 3-[7-hydroxy-2-(1-hydroxy-1-methyl-ethyl)-2,3-dihydrobenzofuran-6-yl]propanoic acid CAS Name: 3-[7-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydrobenzofuran-6-yl]propanoic acid IUPAC Name: 3-[7-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-6-yl]propanoic acid Traditional Name: 3-[7-hydroxy-2-(1-hydroxy-1-methyl-ethyl)coumaran-6-yl]propionic acid Formula: C14H18O5 MolecularWeight: 266.28972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CC2=C(O1)C(=C(C=C2)CCC(=O)O)O)O

Isomeric SMILES

CC(C)(C1CC2=C(O1)C(=C(C=C2)CCC(=O)O)O)O

InChI

InChI=1S/C14H18O5/c1-14(2,18)10-7-9-4-3-8(5-6-11(15)16)12(17)13(9)19-10/h3-4,10,17-18H,5-7H2,1-2H3,(H,15,16)