4,4,5-trimethyl-2,6-di(pyridin-1-ium-1-yl)-3-azabicyclo[3.1.0]hex-2-ene

Systemtic Name: 4,4,5-trimethyl-2,6-di(pyridin-1-ium-1-yl)-3-azabicyclo[3.1.0]hex-2-ene Openeye Name: 4,4,5-trimethyl-2,6-di(pyridin-1-ium-1-yl)-3-azabicyclo[3.1.0]hex-2-ene CAS Name: 4,4,5-trimethyl-2,6-bis(1-pyridin-1-iumyl)-3-azabicyclo[3.1.0]hex-2-ene IUPAC Name: 4,4,5-trimethyl-2,6-di(pyridin-1-ium-1-yl)-3-azabicyclo[3.1.0]hex-2-ene Traditional Name: 4,4,5-trimethyl-2,6-di(pyridin-1-ium-1-yl)-3-azabicyclo[3.1.0]hex-2-ene Formula: C18H21N3+2 MolecularWeight: 279.37944

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(C(C2[N+]3=CC=CC=C3)C(=N1)[N+]4=CC=CC=C4)C)C

Isomeric SMILES

CC1(C2(C(C2[N+]3=CC=CC=C3)C(=N1)[N+]4=CC=CC=C4)C)C

InChI

InChI=1S/C18H21N3/c1-17(2)18(3)14(15(18)20-10-6-4-7-11-20)16(19-17)21-12-8-5-9-13-21/h4-15H,1-3H3/q+2