1-(1-diphenylphosphoryl-1,3-diphenyl-prop-2-ynyl)-4-[3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(1-diphenylphosphoryl-1,3-diphenyl-prop-2-ynyl)-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(1-diphenylphosphoryl-1,3-diphenyl-prop-2-ynyl)-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(1-diphenylphosphoryl-1,3-diphenylprop-2-ynyl)-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(1-diphenylphosphoryl-1,3-diphenylprop-2-ynyl)-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(1-diphenylphosphoryl-1,3-diphenyl-prop-2-ynyl)-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C38H32F3N2OP MolecularWeight: 620.642451

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(C#CC3=CC=CC=C3)(C4=CC=CC=C4)P(=O)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(C#CC3=CC=CC=C3)(C4=CC=CC=C4)P(=O)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H32F3N2OP/c39-38(40,41)33-18-13-19-34(30-33)42-26-28-43(29-27-42)37(32-16-7-2-8-17-32,25-24-31-14-5-1-6-15-31)45(44,35-20-9-3-10-21-35)36-22-11-4-12-23-36/h1-23,30H,26-29H2