(1S,4R)-3-(phenylmethyl)-3-azoniabicyclo[2.2.1]heptane-4-carbonitrile

Systemtic Name: (1S,4R)-3-(phenylmethyl)-3-azoniabicyclo[2.2.1]heptane-4-carbonitrile Openeye Name: (1S,4R)-3-benzyl-3-azoniabicyclo[2.2.1]heptane-4-carbonitrile CAS Name: (1S,4R)-3-(phenylmethyl)-3-azoniabicyclo[2.2.1]heptane-4-carbonitrile IUPAC Name: (1S,4R)-3-benzyl-3-azoniabicyclo[2.2.1]heptane-4-carbonitrile Traditional Name: (1S,4R)-3-benzyl-3-azoniabicyclo[2.2.1]heptane-4-carbonitrile Formula: C14H17N2+ MolecularWeight: 213.29818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1C[NH+]2CC3=CC=CC=C3)C#N

Isomeric SMILES

C1C[C@@]2(C[C@H]1C[NH+]2CC3=CC=CC=C3)C#N

InChI

InChI=1S/C14H16N2/c15-11-14-7-6-13(8-14)10-16(14)9-12-4-2-1-3-5-12/h1-5,13H,6-10H2/p+1/t13-,14+/m0/s1