(E)-6-[1-(4-fluorophenyl)sulfonyl-2-phenyl-pyrrolidin-3-yl]hex-4-enoic acid

Systemtic Name: (E)-6-[1-(4-fluorophenyl)sulfonyl-2-phenyl-pyrrolidin-3-yl]hex-4-enoic acid Openeye Name: (E)-6-[1-(4-fluorophenyl)sulfonyl-2-phenyl-pyrrolidin-3-yl]hex-4-enoic acid CAS Name: (E)-6-[1-(4-fluorophenyl)sulfonyl-2-phenyl-3-pyrrolidinyl]-4-hexenoic acid IUPAC Name: (E)-6-[1-(4-fluorophenyl)sulfonyl-2-phenylpyrrolidin-3-yl]hex-4-enoic acid Traditional Name: (E)-6-[1-(4-fluorophenyl)sulfonyl-2-phenyl-pyrrolidin-3-yl]hex-4-enoic acid Formula: C22H24FNO4S MolecularWeight: 417.493663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1CC=CCCC(=O)O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(C(C1C/C=C/CCC(=O)O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FNO4S/c23-19-11-13-20(14-12-19)29(27,28)24-16-15-18(9-5-2-6-10-21(25)26)22(24)17-7-3-1-4-8-17/h1-5,7-8,11-14,18,22H,6,9-10,15-16H2,(H,25,26)/b5-2+