3-[(4-phenylpyrazol-1-yl)methyl]-1-azabicyclo[2.2.2]octane

Systemtic Name: 3-[(4-phenylpyrazol-1-yl)methyl]-1-azabicyclo[2.2.2]octane Openeye Name: 3-[(4-phenylpyrazol-1-yl)methyl]quinuclidine CAS Name: 3-[(4-phenyl-1-pyrazolyl)methyl]-1-azabicyclo[2.2.2]octane IUPAC Name: 3-[(4-phenylpyrazol-1-yl)methyl]-1-azabicyclo[2.2.2]octane Traditional Name: 3-[(4-phenylpyrazol-1-yl)methyl]quinuclidine Formula: C17H21N3 MolecularWeight: 267.36874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)CN3C=C(C=N3)C4=CC=CC=C4

Isomeric SMILES

C1CN2CCC1C(C2)CN3C=C(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C17H21N3/c1-2-4-14(5-3-1)16-10-18-20(12-16)13-17-11-19-8-6-15(17)7-9-19/h1-5,10,12,15,17H,6-9,11,13H2