(5-nitrofuran-2-yl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (5-nitrofuran-2-yl)methyl-triphenyl-phosphanium bromide Openeye Name: (5-nitro-2-furyl)methyl-triphenyl-phosphonium bromide CAS Name: (5-nitro-2-furanyl)methyl-triphenylphosphonium bromide IUPAC Name: (5-nitrofuran-2-yl)methyl-triphenylphosphanium bromide Traditional Name: (5-nitro-2-furyl)methyl-triphenyl-phosphonium bromide Formula: C23H19BrNO3P MolecularWeight: 468.279621

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC=C(O2)[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC=C(O2)[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C23H19NO3P.BrH/c25-24(26)23-17-16-19(27-23)18-28(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22;/h1-17H,18H2;1H/q+1;/p-1