8-[(2-nitrophenyl)methyl]-8-(phenylmethyl)-8-azoniabicyclo[3.2.1]octane

Systemtic Name: 8-[(2-nitrophenyl)methyl]-8-(phenylmethyl)-8-azoniabicyclo[3.2.1]octane Openeye Name: 8-benzyl-8-[(2-nitrophenyl)methyl]-8-azoniabicyclo[3.2.1]octane CAS Name: 8-[(2-nitrophenyl)methyl]-8-(phenylmethyl)-8-azoniabicyclo[3.2.1]octane IUPAC Name: 8-benzyl-8-[(2-nitrophenyl)methyl]-8-azoniabicyclo[3.2.1]octane Traditional Name: 8-benzyl-8-(2-nitrobenzyl)-8-azoniabicyclo[3.2.1]octane Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCC(C1)[N+]2(CC3=CC=CC=C3)CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CC2CCC(C1)[N+]2(CC3=CC=CC=C3)CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H25N2O2/c24-22(25)21-12-5-4-9-18(21)16-23(15-17-7-2-1-3-8-17)19-10-6-11-20(23)14-13-19/h1-5,7-9,12,19-20H,6,10-11,13-16H2/q+1