benzenesulfonate; bis(triphenyl-$l^{5}-phosphanylidene)azanium

Systemtic Name: benzenesulfonate; bis(triphenyl-$l^{5}-phosphanylidene)azanium Openeye Name: benzenesulfonate; bis(triphenyl-$l^{5}-phosphanylidene)ammonium CAS Name: benzenesulfonate; bis(triphenylphosphoranylidene)ammonium IUPAC Name: benzenesulfonate; bis(triphenyl-$l^{5}-phosphanylidene)azanium Traditional Name: bis(triphenylphosphoranylidene)ammonium besylate Formula: C42H35NO3P2S MolecularWeight: 695.744722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=[N+]=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.C1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)P(=[N+]=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.C1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C36H30NP2.C6H6O3S/c1-7-19-31(20-8-1)38(32-21-9-2-10-22-32,33-23-11-3-12-24-33)37-39(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36;7-10(8,9)6-4-2-1-3-5-6/h1-30H;1-5H,(H,7,8,9)/q+1;/p-1