ethyl 4-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[3,5-bis(trifluoromethyl)anilino]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[3,5-bis(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H17F6N3O3 MolecularWeight: 413.314899

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H17F6N3O3/c1-2-28-14(27)25-5-3-24(4-6-25)13(26)23-12-8-10(15(17,18)19)7-11(9-12)16(20,21)22/h7-9H,2-6H2,1H3,(H,23,26)