ethyl 2-(trifluoromethyl)-4-[4-[4-[9-[2,2,2-tris(fluoranyl)ethylcarbamoyl]fluoren-9-yl]butyl]piperazin-1-yl]benzoate

Systemtic Name: ethyl 2-(trifluoromethyl)-4-[4-[4-[9-[2,2,2-tris(fluoranyl)ethylcarbamoyl]fluoren-9-yl]butyl]piperazin-1-yl]benzoate Openeye Name: ethyl 4-[4-[4-[9-(2,2,2-trifluoroethylcarbamoyl)fluoren-9-yl]butyl]piperazin-1-yl]-2-(trifluoromethyl)benzoate CAS Name: 4-[4-[4-[9-[oxo-(2,2,2-trifluoroethylamino)methyl]-9-fluorenyl]butyl]-1-piperazinyl]-2-(trifluoromethyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-[9-(2,2,2-trifluoroethylcarbamoyl)fluoren-9-yl]butyl]piperazin-1-yl]-2-(trifluoromethyl)benzoate Traditional Name: 4-[4-[4-[9-(2,2,2-trifluoroethylcarbamoyl)fluoren-9-yl]butyl]piperazino]-2-(trifluoromethyl)benzoic acid ethyl ester Formula: C34H35F6N3O3 MolecularWeight: 647.650419

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)N2CCN(CC2)CCCCC3(C4=CC=CC=C4C5=CC=CC=C53)C(=O)NCC(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)N2CCN(CC2)CCCCC3(C4=CC=CC=C4C5=CC=CC=C53)C(=O)NCC(F)(F)F)C(F)(F)F

InChI

InChI=1S/C34H35F6N3O3/c1-2-46-30(44)26-14-13-23(21-29(26)34(38,39)40)43-19-17-42(18-20-43)16-8-7-15-32(31(45)41-22-33(35,36)37)27-11-5-3-9-24(27)25-10-4-6-12-28(25)32/h3-6,9-14,21H,2,7-8,15-20,22H2,1H3,(H,41,45)