ethyl 5-[(4-cyano-2-fluoranyl-phenyl)carbonylamino]-2-morpholin-4-yl-benzoate

Systemtic Name: ethyl 5-[(4-cyano-2-fluoranyl-phenyl)carbonylamino]-2-morpholin-4-yl-benzoate Openeye Name: ethyl 5-[(4-cyano-2-fluoro-benzoyl)amino]-2-morpholino-benzoate CAS Name: 5-[[(4-cyano-2-fluorophenyl)-oxomethyl]amino]-2-(4-morpholinyl)benzoic acid ethyl ester IUPAC Name: ethyl 5-[(4-cyano-2-fluorobenzoyl)amino]-2-morpholin-4-ylbenzoate Traditional Name: 5-[(4-cyano-2-fluoro-benzoyl)amino]-2-morpholino-benzoic acid ethyl ester Formula: C21H20FN3O4 MolecularWeight: 397.399603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C=C(C=C2)C#N)F)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=C(C=C(C=C2)C#N)F)N3CCOCC3

InChI

InChI=1S/C21H20FN3O4/c1-2-29-21(27)17-12-15(4-6-19(17)25-7-9-28-10-8-25)24-20(26)16-5-3-14(13-23)11-18(16)22/h3-6,11-12H,2,7-10H2,1H3,(H,24,26)