ethyl 4-[4-[5-[9-[2,2,2-tris(fluoranyl)ethylcarbamoyl]fluoren-9-yl]pentyl]piperazin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-[5-[9-[2,2,2-tris(fluoranyl)ethylcarbamoyl]fluoren-9-yl]pentyl]piperazin-1-yl]benzoate Openeye Name: ethyl 4-[4-[5-[9-(2,2,2-trifluoroethylcarbamoyl)fluoren-9-yl]pentyl]piperazin-1-yl]benzoate CAS Name: 4-[4-[5-[9-[oxo-(2,2,2-trifluoroethylamino)methyl]-9-fluorenyl]pentyl]-1-piperazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[5-[9-(2,2,2-trifluoroethylcarbamoyl)fluoren-9-yl]pentyl]piperazin-1-yl]benzoate Traditional Name: 4-[4-[5-[9-(2,2,2-trifluoroethylcarbamoyl)fluoren-9-yl]pentyl]piperazino]benzoic acid ethyl ester Formula: C34H38F3N3O3 MolecularWeight: 593.67903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)CCCCCC3(C4=CC=CC=C4C5=CC=CC=C53)C(=O)NCC(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)CCCCCC3(C4=CC=CC=C4C5=CC=CC=C53)C(=O)NCC(F)(F)F

InChI

InChI=1S/C34H38F3N3O3/c1-2-43-31(41)25-14-16-26(17-15-25)40-22-20-39(21-23-40)19-9-3-8-18-33(32(42)38-24-34(35,36)37)29-12-6-4-10-27(29)28-11-5-7-13-30(28)33/h4-7,10-17H,2-3,8-9,18-24H2,1H3,(H,38,42)