3-[3-(3-chloranyl-5-fluoranyl-phenyl)-5-[(3R)-3-oxidanylpyrrolidin-1-yl]carbonyl-furan-2-yl]benzenecarbonitrile

Systemtic Name: 3-[3-(3-chloranyl-5-fluoranyl-phenyl)-5-[(3R)-3-oxidanylpyrrolidin-1-yl]carbonyl-furan-2-yl]benzenecarbonitrile Openeye Name: 3-[3-(3-chloro-5-fluoro-phenyl)-5-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-2-furyl]benzonitrile CAS Name: 3-[3-(3-chloro-5-fluorophenyl)-5-[[(3R)-3-hydroxy-1-pyrrolidinyl]-oxomethyl]-2-furanyl]benzonitrile IUPAC Name: 3-[3-(3-chloro-5-fluorophenyl)-5-[(3R)-3-hydroxypyrrolidine-1-carbonyl]furan-2-yl]benzonitrile Traditional Name: 3-[3-(3-chloro-5-fluoro-phenyl)-5-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-2-furyl]benzonitrile Formula: C22H16ClFN2O3 MolecularWeight: 410.825443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)C(=O)C2=CC(=C(O2)C3=CC=CC(=C3)C#N)C4=CC(=CC(=C4)Cl)F

Isomeric SMILES

C1CN(C[C@@H]1O)C(=O)C2=CC(=C(O2)C3=CC=CC(=C3)C#N)C4=CC(=CC(=C4)Cl)F

InChI

InChI=1S/C22H16ClFN2O3/c23-16-7-15(8-17(24)9-16)19-10-20(22(28)26-5-4-18(27)12-26)29-21(19)14-3-1-2-13(6-14)11-25/h1-3,6-10,18,27H,4-5,12H2/t18-/m1/s1