(2-cyano-1,3-benzoxazol-6-yl)methyl-triphenyl-phosphanium

Systemtic Name: (2-cyano-1,3-benzoxazol-6-yl)methyl-triphenyl-phosphanium Openeye Name: (2-cyano-1,3-benzoxazol-6-yl)methyl-triphenyl-phosphonium CAS Name: (2-cyano-1,3-benzoxazol-6-yl)methyl-triphenylphosphonium IUPAC Name: (2-cyano-1,3-benzoxazol-6-yl)methyl-triphenylphosphanium Traditional Name: (2-cyano-1,3-benzoxazol-6-yl)methyl-triphenyl-phosphonium Formula: C27H20N2OP+ MolecularWeight: 419.434261

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC3=C(C=C2)N=C(O3)C#N)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC3=C(C=C2)N=C(O3)C#N)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H20N2OP/c28-19-27-29-25-17-16-21(18-26(25)30-27)20-31(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-18H,20H2/q+1