4-[1-(4-nitrophenyl)pyrrolidin-3-yl]-1-aza-4-azoniabicyclo[2.2.2]octane

Systemtic Name: 4-[1-(4-nitrophenyl)pyrrolidin-3-yl]-1-aza-4-azoniabicyclo[2.2.2]octane Openeye Name: 4-[1-(4-nitrophenyl)pyrrolidin-3-yl]-1-aza-4-azoniabicyclo[2.2.2]octane CAS Name: 4-[1-(4-nitrophenyl)-3-pyrrolidinyl]-1-aza-4-azoniabicyclo[2.2.2]octane IUPAC Name: 4-[1-(4-nitrophenyl)pyrrolidin-3-yl]-1-aza-4-azoniabicyclo[2.2.2]octane Traditional Name: 4-[1-(4-nitrophenyl)pyrrolidin-3-yl]-1-aza-4-azoniabicyclo[2.2.2]octane Formula: C16H23N4O2+ MolecularWeight: 303.37942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1[N+]23CCN(CC2)CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC1[N+]23CCN(CC2)CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H23N4O2/c21-19(22)15-3-1-14(2-4-15)18-6-5-16(13-18)20-10-7-17(8-11-20)9-12-20/h1-4,16H,5-13H2/q+1