ethyl 4-[(3-chloranyl-2-fluoranyl-phenyl)carbamoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(3-chloranyl-2-fluoranyl-phenyl)carbamoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(3-chloro-2-fluoro-phenyl)carbamoyl]piperazine-1-carboxylate CAS Name: 4-[(3-chloro-2-fluoroanilino)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-chloro-2-fluorophenyl)carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(3-chloro-2-fluoro-phenyl)carbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C14H17ClFN3O3 MolecularWeight: 329.754483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClFN3O3/c1-2-22-14(21)19-8-6-18(7-9-19)13(20)17-11-5-3-4-10(15)12(11)16/h3-5H,2,6-9H2,1H3,(H,17,20)