5,5-bis(fluoranyl)-5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)pentanoic acid

Systemtic Name: 5,5-bis(fluoranyl)-5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)pentanoic acid Openeye Name: 5,5-difluoro-5-(2-methyl-2,3-dihydrobenzofuran-5-yl)pentanoic acid CAS Name: 5,5-difluoro-5-(2-methyl-2,3-dihydrobenzofuran-5-yl)pentanoic acid IUPAC Name: 5,5-difluoro-5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)pentanoic acid Traditional Name: 5,5-difluoro-5-(2-methylcoumaran-5-yl)valeric acid Formula: C14H16F2O3 MolecularWeight: 270.271846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C(CCCC(=O)O)(F)F

Isomeric SMILES

CC1CC2=C(O1)C=CC(=C2)C(CCCC(=O)O)(F)F

InChI

InChI=1S/C14H16F2O3/c1-9-7-10-8-11(4-5-12(10)19-9)14(15,16)6-2-3-13(17)18/h4-5,8-9H,2-3,6-7H2,1H3,(H,17,18)