methyl 2-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylamino]propanoate

Systemtic Name: methyl 2-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylamino]propanoate Openeye Name: methyl 2-[[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]amino]propanoate CAS Name: 2-[[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]amino]propanoate Traditional Name: 2-[[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]amino]propionic acid methyl ester Formula: C16H20F3N3O3 MolecularWeight: 359.34351

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C(=O)OC)NC(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C16H20F3N3O3/c1-11(14(23)25-2)20-15(24)22-8-6-21(7-9-22)13-5-3-4-12(10-13)16(17,18)19/h3-5,10-11H,6-9H2,1-2H3,(H,20,24)