(3-methoxyphenyl)-[(4-nitrophenyl)methyl]-diphenyl-phosphanium bromide

Systemtic Name: (3-methoxyphenyl)-[(4-nitrophenyl)methyl]-diphenyl-phosphanium bromide Openeye Name: (3-methoxyphenyl)-[(4-nitrophenyl)methyl]-diphenyl-phosphonium bromide CAS Name: (3-methoxyphenyl)-[(4-nitrophenyl)methyl]-diphenylphosphonium bromide IUPAC Name: (3-methoxyphenyl)-[(4-nitrophenyl)methyl]-diphenylphosphanium bromide Traditional Name: (3-methoxyphenyl)-(4-nitrobenzyl)-diphenyl-phosphonium bromide Formula: C26H23BrNO3P MolecularWeight: 508.343481

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)[P+](CC2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC1=CC(=CC=C1)[P+](CC2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C26H23NO3P.BrH/c1-30-23-9-8-14-26(19-23)31(24-10-4-2-5-11-24,25-12-6-3-7-13-25)20-21-15-17-22(18-16-21)27(28)29;/h2-19H,20H2,1H3;1H/q+1;/p-1