ethyl 4-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]amino]benzoic acid ethyl ester Formula: C21H22F3N3O3 MolecularWeight: 421.41289

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H22F3N3O3/c1-2-30-19(28)15-6-8-17(9-7-15)25-20(29)27-12-10-26(11-13-27)18-5-3-4-16(14-18)21(22,23)24/h3-9,14H,2,10-13H2,1H3,(H,25,29)