[4-(4-cyanobutoxy)phenyl]methyl-triphenyl-phosphanium

Systemtic Name: [4-(4-cyanobutoxy)phenyl]methyl-triphenyl-phosphanium Openeye Name: [4-(4-cyanobutoxy)phenyl]methyl-triphenyl-phosphonium CAS Name: [4-(4-cyanobutoxy)phenyl]methyl-triphenylphosphonium IUPAC Name: [4-(4-cyanobutoxy)phenyl]methyl-triphenylphosphanium Traditional Name: [4-(4-cyanobutoxy)benzyl]-triphenyl-phosphonium Formula: C30H29NOP+ MolecularWeight: 450.531121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)OCCCCC#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)OCCCCC#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H29NOP/c31-23-11-4-12-24-32-27-21-19-26(20-22-27)25-33(28-13-5-1-6-14-28,29-15-7-2-8-16-29)30-17-9-3-10-18-30/h1-3,5-10,13-22H,4,11-12,24-25H2/q+1