3-[3-fluoranyl-4-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]carbonyl-phenyl]benzenecarbonitrile

Systemtic Name: 3-[3-fluoranyl-4-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]carbonyl-phenyl]benzenecarbonitrile Openeye Name: 3-[3-fluoro-4-[2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carbonyl]phenyl]benzonitrile CAS Name: 3-[3-fluoro-4-[oxo-[2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]methyl]phenyl]benzonitrile IUPAC Name: 3-[3-fluoro-4-[2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carbonyl]phenyl]benzonitrile Traditional Name: 3-[3-fluoro-4-[2-(pyrrolidinomethyl)pyrrolidine-1-carbonyl]phenyl]benzonitrile Formula: C23H24FN3O MolecularWeight: 377.454563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2CCCN2C(=O)C3=C(C=C(C=C3)C4=CC=CC(=C4)C#N)F

Isomeric SMILES

C1CCN(C1)CC2CCCN2C(=O)C3=C(C=C(C=C3)C4=CC=CC(=C4)C#N)F

InChI

InChI=1S/C23H24FN3O/c24-22-14-19(18-6-3-5-17(13-18)15-25)8-9-21(22)23(28)27-12-4-7-20(27)16-26-10-1-2-11-26/h3,5-6,8-9,13-14,20H,1-2,4,7,10-12,16H2