1-[(4-bromanyl-2-nitro-phenyl)methyl]pyridin-1-ium bromide

Systemtic Name: 1-[(4-bromanyl-2-nitro-phenyl)methyl]pyridin-1-ium bromide Openeye Name: 1-[(4-bromo-2-nitro-phenyl)methyl]pyridin-1-ium bromide CAS Name: 1-[(4-bromo-2-nitrophenyl)methyl]pyridin-1-ium bromide IUPAC Name: 1-[(4-bromo-2-nitrophenyl)methyl]pyridin-1-ium bromide Traditional Name: 1-(4-bromo-2-nitro-benzyl)pyridin-1-ium bromide Formula: C12H10Br2N2O2 MolecularWeight: 374.028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10BrN2O2.BrH/c13-11-5-4-10(12(8-11)15(16)17)9-14-6-2-1-3-7-14;/h1-8H,9H2;1H/q+1;/p-1