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

Systemtic Name: ethyl 4-[[5-(5-cyano-2-fluoranyl-phenyl)-1,2-oxazol-3-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[5-(5-cyano-2-fluoro-phenyl)isoxazol-3-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[5-(5-cyano-2-fluorophenyl)-3-isoxazolyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(5-cyano-2-fluorophenyl)-1,2-oxazol-3-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[5-(5-cyano-2-fluoro-phenyl)isoxazol-3-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H19FN4O3 MolecularWeight: 358.366863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19FN4O3/c1-2-25-18(24)23-7-5-22(6-8-23)12-14-10-17(26-21-14)15-9-13(11-20)3-4-16(15)19/h3-4,9-10H,2,5-8,12H2,1H3