(5-cyano-3-methyl-1-benzofuran-2-yl)methyl-triphenyl-phosphanium

Systemtic Name: (5-cyano-3-methyl-1-benzofuran-2-yl)methyl-triphenyl-phosphanium Openeye Name: (5-cyano-3-methyl-benzofuran-2-yl)methyl-triphenyl-phosphonium CAS Name: (5-cyano-3-methyl-2-benzofuranyl)methyl-triphenylphosphonium IUPAC Name: (5-cyano-3-methyl-1-benzofuran-2-yl)methyl-triphenylphosphanium Traditional Name: (5-cyano-3-methyl-benzofuran-2-yl)methyl-triphenyl-phosphonium Formula: C29H23NOP+ MolecularWeight: 432.472781

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)C#N)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)C#N)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H23NOP/c1-22-27-19-23(20-30)17-18-28(27)31-29(22)21-32(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-19H,21H2,1H3/q+1