4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-fluoranyl-benzenecarbonitrile Openeye Name: 3-fluoro-4-(quinuclidin-3-ylamino)benzonitrile CAS Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-fluorobenzonitrile IUPAC Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-fluorobenzonitrile Traditional Name: 3-fluoro-4-(quinuclidin-3-ylamino)benzonitrile Formula: C14H16FN3 MolecularWeight: 245.295343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

C1CN2CCC1C(C2)NC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C14H16FN3/c15-12-7-10(8-16)1-2-13(12)17-14-9-18-5-3-11(14)4-6-18/h1-2,7,11,14,17H,3-6,9H2