7-[2-[(E)-4-(1-benzofuran-2-yl)-4,4-bis(fluoranyl)-3-oxidanyl-but-1-enyl]-6-oxidanylidene-piperidin-1-yl]heptanoic acid

Systemtic Name: 7-[2-[(E)-4-(1-benzofuran-2-yl)-4,4-bis(fluoranyl)-3-oxidanyl-but-1-enyl]-6-oxidanylidene-piperidin-1-yl]heptanoic acid Openeye Name: 7-[2-[(E)-4-(benzofuran-2-yl)-4,4-difluoro-3-hydroxy-but-1-enyl]-6-oxo-1-piperidyl]heptanoic acid CAS Name: 7-[2-[(E)-4-(2-benzofuranyl)-4,4-difluoro-3-hydroxybut-1-enyl]-6-oxo-1-piperidinyl]heptanoic acid IUPAC Name: 7-[2-[(E)-4-(1-benzofuran-2-yl)-4,4-difluoro-3-hydroxybut-1-enyl]-6-oxopiperidin-1-yl]heptanoic acid Traditional Name: 7-[2-[(E)-4-(benzofuran-2-yl)-4,4-difluoro-3-hydroxy-but-1-enyl]-6-keto-piperidino]enanthic acid Formula: C24H29F2NO5 MolecularWeight: 449.487566

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C(=O)C1)CCCCCCC(=O)O)C=CC(C(C2=CC3=CC=CC=C3O2)(F)F)O

Isomeric SMILES

C1CC(N(C(=O)C1)CCCCCCC(=O)O)/C=C/C(C(C2=CC3=CC=CC=C3O2)(F)F)O

InChI

InChI=1S/C24H29F2NO5/c25-24(26,21-16-17-8-4-5-10-19(17)32-21)20(28)14-13-18-9-7-11-22(29)27(18)15-6-2-1-3-12-23(30)31/h4-5,8,10,13-14,16,18,20,28H,1-3,6-7,9,11-12,15H2,(H,30,31)/b14-13+