(E)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,4-dimethoxy-4-oxidanylidene-2-triphenylphosphaniumyl-but-1-en-1-olate

Systemtic Name: (E)-3-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,4-dimethoxy-4-oxidanylidene-2-triphenylphosphaniumyl-but-1-en-1-olate Openeye Name: (E)-3-(1,3-dioxoisoindolin-2-yl)-1,4-dimethoxy-4-oxo-2-triphenylphosphaniumyl-but-1-en-1-olate CAS Name: (E)-3-(1,3-dioxo-2-isoindolyl)-1,4-dimethoxy-4-oxo-2-triphenylphosphiniumyl-1-buten-1-olate IUPAC Name: (E)-3-(1,3-dioxoisoindol-2-yl)-1,4-dimethoxy-4-oxo-2-triphenylphosphaniumylbut-1-en-1-olate Traditional Name: (E)-4-keto-1,4-dimethoxy-3-phthalimido-2-triphenylphosphiniumyl-but-1-en-1-olate Formula: C32H26NO6P MolecularWeight: 551.525701

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=C([O-])OC)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

COC(=O)C(/C(=C(/[O-])\OC)/[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C32H26NO6P/c1-38-31(36)27(33-29(34)25-20-12-13-21-26(25)30(33)35)28(32(37)39-2)40(22-14-6-3-7-15-22,23-16-8-4-9-17-23)24-18-10-5-11-19-24/h3-21,27H,1-2H3/b32-28+