ethyl 4-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[2-chloro-5-(trifluoromethyl)anilino]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H17ClF3N3O3 MolecularWeight: 379.76199

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClF3N3O3/c1-2-25-14(24)22-7-5-21(6-8-22)13(23)20-12-9-10(15(17,18)19)3-4-11(12)16/h3-4,9H,2,5-8H2,1H3,(H,20,23)