2,4-dinitrobenzenesulfonate; methyl(triphenyl)phosphanium

Systemtic Name: 2,4-dinitrobenzenesulfonate; methyl(triphenyl)phosphanium Openeye Name: 2,4-dinitrobenzenesulfonate; methyl(triphenyl)phosphonium CAS Name: 2,4-dinitrobenzenesulfonate; methyl(triphenyl)phosphonium IUPAC Name: 2,4-dinitrobenzenesulfonate; methyl(triphenyl)phosphanium Traditional Name: 2,4-dinitrobesylate; methyl(triphenyl)phosphonium Formula: C25H21N2O7PS MolecularWeight: 524.482201

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Descriptors Computed from Structure

Canonical SMILES:

C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-]

Isomeric SMILES

C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-]

InChI

InChI=1S/C19H18P.C6H4N2O7S/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;9-7(10)4-1-2-6(16(13,14)15)5(3-4)8(11)12/h2-16H,1H3;1-3H,(H,13,14,15)/q+1;/p-1