sodium 2-(4-methylphenyl)-2-oxidanylidene-1-(triphenyl-$l^{5}-phosphanylidene)ethanesulfonate

Systemtic Name: sodium 2-(4-methylphenyl)-2-oxidanylidene-1-(triphenyl-$l^{5}-phosphanylidene)ethanesulfonate Openeye Name: sodium 2-oxo-2-(p-tolyl)-1-(triphenyl-$l^{5}-phosphanylidene)ethanesulfonate CAS Name: sodium 2-(4-methylphenyl)-2-oxo-1-triphenylphosphoranylideneethanesulfonate IUPAC Name: sodium 2-(4-methylphenyl)-2-oxo-1-(triphenyl-$l^{5}-phosphanylidene)ethanesulfonate Traditional Name: sodium 2-keto-2-(p-tolyl)-1-triphenylphosphoranylidene-ethanesulfonate Formula: C27H22NaO4PS MolecularWeight: 496.489711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C27H23O4PS.Na/c1-21-17-19-22(20-18-21)26(28)27(33(29,30)31)32(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25;/h2-20H,1H3,(H,29,30,31);/q;+1/p-1