(Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-5-oxidanylidene-4-phenyl-2-triphenylphosphaniumyl-hept-1-en-1-olate

Systemtic Name: (Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-5-oxidanylidene-4-phenyl-2-triphenylphosphaniumyl-hept-1-en-1-olate Openeye Name: (Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-5-oxo-4-phenyl-2-triphenylphosphaniumyl-hept-1-en-1-olate CAS Name: (Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-5-oxo-4-phenyl-2-triphenylphosphiniumyl-1-hepten-1-olate IUPAC Name: (Z)-4-cyano-1-ethoxy-3-ethoxycarbonyl-5-oxo-4-phenyl-2-triphenylphosphaniumylhept-1-en-1-olate Traditional Name: (Z)-3-carbethoxy-4-cyano-1-ethoxy-5-keto-4-phenyl-2-triphenylphosphiniumyl-hept-1-en-1-olate Formula: C37H36NO5P MolecularWeight: 605.659201

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C#N)(C1=CC=CC=C1)C(C(=C([O-])OCC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCC(=O)C(C#N)(C1=CC=CC=C1)C(/C(=C(\[O-])/OCC)/[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C37H36NO5P/c1-4-32(39)37(27-38,28-19-11-7-12-20-28)33(35(40)42-5-2)34(36(41)43-6-3)44(29-21-13-8-14-22-29,30-23-15-9-16-24-30)31-25-17-10-18-26-31/h7-26,33H,4-6H2,1-3H3/b36-34-