[1-chloranyl-1-cyano-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]-triphenyl-phosphanium

Systemtic Name: [1-chloranyl-1-cyano-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]-triphenyl-phosphanium Openeye Name: [1-chloro-1-cyano-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-triphenyl-phosphonium CAS Name: [1-chloro-1-cyano-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-triphenylphosphonium IUPAC Name: [1-chloro-1-cyano-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-triphenylphosphanium Traditional Name: [1-chloro-1-cyano-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-triphenyl-phosphonium Formula: C26H25ClF3NOP+ MolecularWeight: 490.904771

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25ClF3NOP/c1-20(2)18-24(32,26(28,29)30)25(27,19-31)33(21-12-6-3-7-13-21,22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,20,32H,18H2,1-2H3/q+1