(1S,4R)-5-(phenylmethyl)-5-azoniabicyclo[2.2.2]oct-2-ene

Systemtic Name: (1S,4R)-5-(phenylmethyl)-5-azoniabicyclo[2.2.2]oct-2-ene Openeye Name: (1S,4R)-5-benzyl-5-azoniabicyclo[2.2.2]oct-2-ene CAS Name: (1S,4R)-5-(phenylmethyl)-5-azoniabicyclo[2.2.2]oct-2-ene IUPAC Name: (1S,4R)-5-benzyl-5-azoniabicyclo[2.2.2]oct-2-ene Traditional Name: (1S,4R)-5-benzyl-5-azoniabicyclo[2.2.2]oct-2-ene Formula: C14H18N+ MolecularWeight: 200.29942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CC1C[NH+]2CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H]2C=C[C@H]1C[NH+]2CC3=CC=CC=C3

InChI

InChI=1S/C14H17N/c1-2-4-12(5-3-1)10-15-11-13-6-8-14(15)9-7-13/h1-6,8,13-14H,7,9-11H2/p+1/t13-,14+/m1/s1