[1-chloranyl-1-cyano-2-oxidanyl-4-phenyl-2-(trifluoromethyl)but-3-ynyl]-triphenyl-phosphanium

Systemtic Name: [1-chloranyl-1-cyano-2-oxidanyl-4-phenyl-2-(trifluoromethyl)but-3-ynyl]-triphenyl-phosphanium Openeye Name: [1-chloro-1-cyano-2-hydroxy-4-phenyl-2-(trifluoromethyl)but-3-ynyl]-triphenyl-phosphonium CAS Name: [1-chloro-1-cyano-2-hydroxy-4-phenyl-2-(trifluoromethyl)but-3-ynyl]-triphenylphosphonium IUPAC Name: [1-chloro-1-cyano-2-hydroxy-4-phenyl-2-(trifluoromethyl)but-3-ynyl]-triphenylphosphanium Traditional Name: [1-chloro-1-cyano-2-hydroxy-4-phenyl-2-(trifluoromethyl)but-3-ynyl]-triphenyl-phosphonium Formula: C30H21ClF3NOP+ MolecularWeight: 534.915811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC(C(C#N)([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl)(C(F)(F)F)O

Isomeric SMILES

C1=CC=C(C=C1)C#CC(C(C#N)([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl)(C(F)(F)F)O

InChI

InChI=1S/C30H21ClF3NOP/c31-29(23-35,28(36,30(32,33)34)22-21-24-13-5-1-6-14-24)37(25-15-7-2-8-16-25,26-17-9-3-10-18-26)27-19-11-4-12-20-27/h1-20,36H/q+1