ethyl 4-[[5-(5-chloranyl-2-fluoranyl-phenyl)-1,2-oxazol-3-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(5-chloranyl-2-fluoranyl-phenyl)-1,2-oxazol-3-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[5-(5-chloro-2-fluoro-phenyl)isoxazol-3-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[5-(5-chloro-2-fluorophenyl)-3-isoxazolyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(5-chloro-2-fluorophenyl)-1,2-oxazol-3-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[5-(5-chloro-2-fluoro-phenyl)isoxazol-3-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H19ClFN3O3 MolecularWeight: 367.802463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=NOC(=C2)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=NOC(=C2)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C17H19ClFN3O3/c1-2-24-17(23)22-7-5-21(6-8-22)11-13-10-16(25-20-13)14-9-12(18)3-4-15(14)19/h3-4,9-10H,2,5-8,11H2,1H3