1-[(4-nitrophenyl)methyl]pyridin-1-ium-4-amine chloride

Systemtic Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium-4-amine chloride Openeye Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium-4-amine chloride CAS Name: 1-[(4-nitrophenyl)methyl]-4-pyridin-1-iumamine chloride IUPAC Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium-4-amine chloride Traditional Name: [1-(4-nitrobenzyl)pyridin-1-ium-4-yl]amine chloride Formula: C12H12ClN3O2 MolecularWeight: 265.69558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[N+]2=CC=C(C=C2)N)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC(=CC=C1C[N+]2=CC=C(C=C2)N)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C12H11N3O2.ClH/c13-11-5-7-14(8-6-11)9-10-1-3-12(4-2-10)15(16)17;/h1-8,13H,9H2;1H