(E)-1,4-dimethoxy-3-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-2-triphenylphosphaniumyl-but-1-en-1-olate

Systemtic Name: (E)-1,4-dimethoxy-3-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-2-triphenylphosphaniumyl-but-1-en-1-olate Openeye Name: (E)-1,4-dimethoxy-4-oxo-3-(p-tolylsulfonylamino)-2-triphenylphosphaniumyl-but-1-en-1-olate CAS Name: (E)-1,4-dimethoxy-3-[(4-methylphenyl)sulfonylamino]-4-oxo-2-triphenylphosphiniumyl-1-buten-1-olate IUPAC Name: (E)-1,4-dimethoxy-3-[(4-methylphenyl)sulfonylamino]-4-oxo-2-triphenylphosphaniumylbut-1-en-1-olate Traditional Name: (E)-4-keto-1,4-dimethoxy-3-(tosylamino)-2-triphenylphosphiniumyl-but-1-en-1-olate Formula: C31H30NO6PS MolecularWeight: 575.611761

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(/C(=C(/[O-])\OC)/[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C31H30NO6PS/c1-23-19-21-27(22-20-23)40(35,36)32-28(30(33)37-2)29(31(34)38-3)39(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-22,28,32H,1-3H3/b31-29+