1-butyl-5-(diphenylphosphorylmethyl)-2-hex-1-ynyl-3-[4-(trifluoromethyl)phenyl]benzene

Systemtic Name: 1-butyl-5-(diphenylphosphorylmethyl)-2-hex-1-ynyl-3-[4-(trifluoromethyl)phenyl]benzene Openeye Name: 1-butyl-5-(diphenylphosphorylmethyl)-2-hex-1-ynyl-3-[4-(trifluoromethyl)phenyl]benzene CAS Name: 1-butyl-5-(diphenylphosphorylmethyl)-2-hex-1-ynyl-3-[4-(trifluoromethyl)phenyl]benzene IUPAC Name: 1-butyl-5-(diphenylphosphorylmethyl)-2-hex-1-ynyl-3-[4-(trifluoromethyl)phenyl]benzene Traditional Name: 1-butyl-5-(diphenylphosphorylmethyl)-2-hex-1-ynyl-3-[4-(trifluoromethyl)phenyl]benzene Formula: C36H36F3OP MolecularWeight: 572.639411

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C=C(C=C1C2=CC=C(C=C2)C(F)(F)F)CP(=O)(C3=CC=CC=C3)C4=CC=CC=C4)CCCC

Isomeric SMILES

CCCCC#CC1=C(C=C(C=C1C2=CC=C(C=C2)C(F)(F)F)CP(=O)(C3=CC=CC=C3)C4=CC=CC=C4)CCCC

InChI

InChI=1S/C36H36F3OP/c1-3-5-7-14-20-34-30(15-6-4-2)25-28(26-35(34)29-21-23-31(24-22-29)36(37,38)39)27-41(40,32-16-10-8-11-17-32)33-18-12-9-13-19-33/h8-13,16-19,21-26H,3-7,15,27H2,1-2H3