1-[2-[(4-nitrophenyl)methyl]-1,3-dioxolan-2-yl]pyridin-1-ium bromide

Systemtic Name: 1-[2-[(4-nitrophenyl)methyl]-1,3-dioxolan-2-yl]pyridin-1-ium bromide Openeye Name: 1-[2-[(4-nitrophenyl)methyl]-1,3-dioxolan-2-yl]pyridin-1-ium bromide CAS Name: 1-[2-[(4-nitrophenyl)methyl]-1,3-dioxolan-2-yl]pyridin-1-ium bromide IUPAC Name: 1-[2-[(4-nitrophenyl)methyl]-1,3-dioxolan-2-yl]pyridin-1-ium bromide Traditional Name: 1-[2-(4-nitrobenzyl)-1,3-dioxolan-2-yl]pyridin-1-ium bromide Formula: C15H15BrN2O4 MolecularWeight: 367.1946

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)(CC2=CC=C(C=C2)[N+](=O)[O-])[N+]3=CC=CC=C3.[Br-]

Isomeric SMILES

C1COC(O1)(CC2=CC=C(C=C2)[N+](=O)[O-])[N+]3=CC=CC=C3.[Br-]

InChI

InChI=1S/C15H15N2O4.BrH/c18-17(19)14-6-4-13(5-7-14)12-15(20-10-11-21-15)16-8-2-1-3-9-16;/h1-9H,10-12H2;1H/q+1;/p-1