(4-methoxy-2,6-dimethyl-3-nitro-phenyl)-diphenyl-(phenylmethyl)phosphanium chloride

Systemtic Name: (4-methoxy-2,6-dimethyl-3-nitro-phenyl)-diphenyl-(phenylmethyl)phosphanium chloride Openeye Name: benzyl-(4-methoxy-2,6-dimethyl-3-nitro-phenyl)-diphenyl-phosphonium chloride CAS Name: (4-methoxy-2,6-dimethyl-3-nitrophenyl)-diphenyl-(phenylmethyl)phosphonium chloride IUPAC Name: benzyl-(4-methoxy-2,6-dimethyl-3-nitrophenyl)-diphenylphosphanium chloride Traditional Name: benzyl-(4-methoxy-2,6-dimethyl-3-nitro-phenyl)-diphenyl-phosphonium chloride Formula: C28H27ClNO3P MolecularWeight: 491.945641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1[P+](CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C)[N+](=O)[O-])OC.[Cl-]

Isomeric SMILES

CC1=CC(=C(C(=C1[P+](CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C)[N+](=O)[O-])OC.[Cl-]

InChI

InChI=1S/C28H27NO3P.ClH/c1-21-19-26(32-3)27(29(30)31)22(2)28(21)33(24-15-9-5-10-16-24,25-17-11-6-12-18-25)20-23-13-7-4-8-14-23;/h4-19H,20H2,1-3H3;1H/q+1;/p-1