(E)-3-oxidanylidene-3-phenyl-1-pyridin-3-yl-2-(triphenylphosphaniumylmethyl)prop-1-en-1-olate

Systemtic Name: (E)-3-oxidanylidene-3-phenyl-1-pyridin-3-yl-2-(triphenylphosphaniumylmethyl)prop-1-en-1-olate Openeye Name: (E)-3-oxo-3-phenyl-1-(3-pyridyl)-2-(triphenylphosphaniumylmethyl)prop-1-en-1-olate CAS Name: (E)-3-oxo-3-phenyl-1-(3-pyridinyl)-2-(triphenylphosphiniumylmethyl)-1-propen-1-olate IUPAC Name: (E)-3-oxo-3-phenyl-1-pyridin-3-yl-2-(triphenylphosphaniumylmethyl)prop-1-en-1-olate Traditional Name: (E)-3-keto-3-phenyl-1-(3-pyridyl)-2-(triphenylphosphiniumylmethyl)prop-1-en-1-olate Formula: C33H26NO2P MolecularWeight: 499.538801

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(=C(C2=CN=CC=C2)[O-])C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C(=C(/C2=CN=CC=C2)\[O-])/C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H26NO2P/c35-32(26-14-5-1-6-15-26)31(33(36)27-16-13-23-34-24-27)25-37(28-17-7-2-8-18-28,29-19-9-3-10-20-29)30-21-11-4-12-22-30/h1-24H,25H2