(5-cyano-7-methoxy-1-benzofuran-2-yl)methyl-triphenyl-phosphanium

Systemtic Name: (5-cyano-7-methoxy-1-benzofuran-2-yl)methyl-triphenyl-phosphanium Openeye Name: (5-cyano-7-methoxy-benzofuran-2-yl)methyl-triphenyl-phosphonium CAS Name: (5-cyano-7-methoxy-2-benzofuranyl)methyl-triphenylphosphonium IUPAC Name: (5-cyano-7-methoxy-1-benzofuran-2-yl)methyl-triphenylphosphanium Traditional Name: (5-cyano-7-methoxy-benzofuran-2-yl)methyl-triphenyl-phosphonium Formula: C29H23NO2P+ MolecularWeight: 448.472181

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OC(=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

COC1=CC(=CC2=C1OC(=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C29H23NO2P/c1-31-28-18-22(20-30)17-23-19-24(32-29(23)28)21-33(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-19H,21H2,1H3/q+1