[(E)-2-(methylamino)-1-phenyl-pent-1-enyl]-triphenyl-phosphanium; tris(fluoranyl)methanesulfonate

Systemtic Name: [(E)-2-(methylamino)-1-phenyl-pent-1-enyl]-triphenyl-phosphanium; tris(fluoranyl)methanesulfonate Openeye Name: [(E)-2-(methylamino)-1-phenyl-pent-1-enyl]-triphenyl-phosphonium; trifluoromethanesulfonate CAS Name: [(E)-2-(methylamino)-1-phenylpent-1-enyl]-triphenylphosphonium; trifluoromethanesulfonate IUPAC Name: [(E)-2-(methylamino)-1-phenylpent-1-enyl]-triphenylphosphanium; trifluoromethanesulfonate Traditional Name: [(E)-2-(methylamino)-1-phenyl-pent-1-enyl]-triphenyl-phosphonium triflate Formula: C31H31F3NO3PS MolecularWeight: 585.616711

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C(C1=CC=CC=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCC/C(=C(/C1=CC=CC=C1)\[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/NC.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C30H31NP.CHF3O3S/c1-3-16-29(31-2)30(25-17-8-4-9-18-25)32(26-19-10-5-11-20-26,27-21-12-6-13-22-27)28-23-14-7-15-24-28;2-1(3,4)8(5,6)7/h4-15,17-24,31H,3,16H2,1-2H3;(H,5,6,7)/q+1;/p-1/b30-29+;