7-[(2R)-2-[(E,3S)-4-[3,4-bis(fluoranyl)phenyl]-3-oxidanyl-but-1-enyl]-5-oxidanylidene-pyrrolidin-1-yl]heptanoic acid

Systemtic Name: 7-[(2R)-2-[(E,3S)-4-[3,4-bis(fluoranyl)phenyl]-3-oxidanyl-but-1-enyl]-5-oxidanylidene-pyrrolidin-1-yl]heptanoic acid Openeye Name: 7-[(2R)-2-[(E,3S)-4-(3,4-difluorophenyl)-3-hydroxy-but-1-enyl]-5-oxo-pyrrolidin-1-yl]heptanoic acid CAS Name: 7-[(2R)-2-[(E,3S)-4-(3,4-difluorophenyl)-3-hydroxybut-1-enyl]-5-oxo-1-pyrrolidinyl]heptanoic acid IUPAC Name: 7-[(2R)-2-[(E,3S)-4-(3,4-difluorophenyl)-3-hydroxybut-1-enyl]-5-oxopyrrolidin-1-yl]heptanoic acid Traditional Name: 7-[(2R)-2-[(E,3S)-4-(3,4-difluorophenyl)-3-hydroxy-but-1-enyl]-5-keto-pyrrolidino]enanthic acid Formula: C21H27F2NO4 MolecularWeight: 395.440186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C=CC(CC2=CC(=C(C=C2)F)F)O)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)N([C@H]1/C=C/[C@H](CC2=CC(=C(C=C2)F)F)O)CCCCCCC(=O)O

InChI

InChI=1S/C21H27F2NO4/c22-18-10-6-15(14-19(18)23)13-17(25)9-7-16-8-11-20(26)24(16)12-4-2-1-3-5-21(27)28/h6-7,9-10,14,16-17,25H,1-5,8,11-13H2,(H,27,28)/b9-7+/t16-,17+/m0/s1