(E)-3-[2-(2-ethoxy-2-oxidanylidene-ethanoyl)pyrrol-1-yl]-1,4-dimethoxy-4-oxidanylidene-2-triphenylphosphaniumyl-but-1-en-1-olate

Systemtic Name: (E)-3-[2-(2-ethoxy-2-oxidanylidene-ethanoyl)pyrrol-1-yl]-1,4-dimethoxy-4-oxidanylidene-2-triphenylphosphaniumyl-but-1-en-1-olate Openeye Name: (E)-3-[2-(2-ethoxy-2-oxo-acetyl)pyrrol-1-yl]-1,4-dimethoxy-4-oxo-2-triphenylphosphaniumyl-but-1-en-1-olate CAS Name: (E)-3-[2-(2-ethoxy-1,2-dioxoethyl)-1-pyrrolyl]-1,4-dimethoxy-4-oxo-2-triphenylphosphiniumyl-1-buten-1-olate IUPAC Name: (E)-3-[2-(2-ethoxy-2-oxoacetyl)pyrrol-1-yl]-1,4-dimethoxy-4-oxo-2-triphenylphosphaniumylbut-1-en-1-olate Traditional Name: (E)-3-(2-ethoxalylpyrrol-1-yl)-4-keto-1,4-dimethoxy-2-triphenylphosphiniumyl-but-1-en-1-olate Formula: C32H30NO7P MolecularWeight: 571.556861

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=CC=CN1C(C(=C([O-])OC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CCOC(=O)C(=O)C1=CC=CN1C(/C(=C(/[O-])\OC)/[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C32H30NO7P/c1-4-40-31(36)28(34)26-21-14-22-33(26)27(30(35)38-2)29(32(37)39-3)41(23-15-8-5-9-16-23,24-17-10-6-11-18-24)25-19-12-7-13-20-25/h5-22,27H,4H2,1-3H3/b32-29+