7-[1-(4-fluorophenyl)sulfonyl-2-(3-hydroxyphenyl)pyrrolidin-3-yl]heptanoic acid

Systemtic Name: 7-[1-(4-fluorophenyl)sulfonyl-2-(3-hydroxyphenyl)pyrrolidin-3-yl]heptanoic acid Openeye Name: 7-[1-(4-fluorophenyl)sulfonyl-2-(3-hydroxyphenyl)pyrrolidin-3-yl]heptanoic acid CAS Name: 7-[1-(4-fluorophenyl)sulfonyl-2-(3-hydroxyphenyl)-3-pyrrolidinyl]heptanoic acid IUPAC Name: 7-[1-(4-fluorophenyl)sulfonyl-2-(3-hydroxyphenyl)pyrrolidin-3-yl]heptanoic acid Traditional Name: 7-[1-(4-fluorophenyl)sulfonyl-2-(3-hydroxyphenyl)pyrrolidin-3-yl]enanthic acid Formula: C23H28FNO5S MolecularWeight: 449.535523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1CCCCCCC(=O)O)C2=CC(=CC=C2)O)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(C(C1CCCCCCC(=O)O)C2=CC(=CC=C2)O)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H28FNO5S/c24-19-10-12-21(13-11-19)31(29,30)25-15-14-17(6-3-1-2-4-9-22(27)28)23(25)18-7-5-8-20(26)16-18/h5,7-8,10-13,16-17,23,26H,1-4,6,9,14-15H2,(H,27,28)