3-[3,6-bis(oxidanyl)-2-propan-2-yl-1-benzofuran-5-yl]propanoic acid

Systemtic Name: 3-[3,6-bis(oxidanyl)-2-propan-2-yl-1-benzofuran-5-yl]propanoic acid Openeye Name: 3-(3,6-dihydroxy-2-isopropyl-benzofuran-5-yl)propanoic acid CAS Name: 3-(3,6-dihydroxy-2-propan-2-yl-5-benzofuranyl)propanoic acid IUPAC Name: 3-(3,6-dihydroxy-2-propan-2-yl-1-benzofuran-5-yl)propanoic acid Traditional Name: 3-(3,6-dihydroxy-2-isopropyl-benzofuran-5-yl)propionic acid Formula: C14H16O5 MolecularWeight: 264.27384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=CC(=C(C=C2O1)O)CCC(=O)O)O

Isomeric SMILES

CC(C)C1=C(C2=CC(=C(C=C2O1)O)CCC(=O)O)O

InChI

InChI=1S/C14H16O5/c1-7(2)14-13(18)9-5-8(3-4-12(16)17)10(15)6-11(9)19-14/h5-7,15,18H,3-4H2,1-2H3,(H,16,17)