1-[2-(4-nitrophenyl)ethyl]pyridin-1-ium bromide

Systemtic Name: 1-[2-(4-nitrophenyl)ethyl]pyridin-1-ium bromide Openeye Name: 1-[2-(4-nitrophenyl)ethyl]pyridin-1-ium bromide CAS Name: 1-[2-(4-nitrophenyl)ethyl]pyridin-1-ium bromide IUPAC Name: 1-[2-(4-nitrophenyl)ethyl]pyridin-1-ium bromide Traditional Name: 1-[2-(4-nitrophenyl)ethyl]pyridin-1-ium bromide Formula: C13H13BrN2O2 MolecularWeight: 309.15852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CCC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1=CC=[N+](C=C1)CCC2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C13H13N2O2.BrH/c16-15(17)13-6-4-12(5-7-13)8-11-14-9-2-1-3-10-14;/h1-7,9-10H,8,11H2;1H/q+1;/p-1