1-[(4-nitrophenyl)methyl]pyridin-1-ium bromide

Systemtic Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium bromide Openeye Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium bromide CAS Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium bromide IUPAC Name: 1-[(4-nitrophenyl)methyl]pyridin-1-ium bromide Traditional Name: 1-(4-nitrobenzyl)pyridin-1-ium bromide Formula: C12H11BrN2O2 MolecularWeight: 295.13194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C12H11N2O2.BrH/c15-14(16)12-6-4-11(5-7-12)10-13-8-2-1-3-9-13;/h1-9H,10H2;1H/q+1;/p-1