4-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-chloranyl-benzenecarbonitrile

Systemtic Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-chloranyl-benzenecarbonitrile Openeye Name: 2-chloro-4-(quinuclidin-3-ylamino)benzonitrile CAS Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-chlorobenzonitrile IUPAC Name: 4-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-chlorobenzonitrile Traditional Name: 2-chloro-4-(quinuclidin-3-ylamino)benzonitrile Formula: C14H16ClN3 MolecularWeight: 261.74994

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

C1CN2CCC1C(C2)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C14H16ClN3/c15-13-7-12(2-1-11(13)8-16)17-14-9-18-5-3-10(14)4-6-18/h1-2,7,10,14,17H,3-6,9H2