methyl 3-[[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]amino]-4-fluoranyl-benzoate

Systemtic Name: methyl 3-[[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]amino]-4-fluoranyl-benzoate Openeye Name: methyl 3-[[2-[(3-tert-butylisoxazol-5-yl)amino]-2-oxo-ethyl]amino]-4-fluoro-benzoate CAS Name: 3-[[2-[(3-tert-butyl-5-isoxazolyl)amino]-2-oxoethyl]amino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]amino]-4-fluorobenzoate Traditional Name: 3-[[2-[(3-tert-butylisoxazol-5-yl)amino]-2-keto-ethyl]amino]-4-fluoro-benzoic acid methyl ester Formula: C17H20FN3O4 MolecularWeight: 349.356803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1)NC(=O)CNC2=C(C=CC(=C2)C(=O)OC)F

Isomeric SMILES

CC(C)(C)C1=NOC(=C1)NC(=O)CNC2=C(C=CC(=C2)C(=O)OC)F

InChI

InChI=1S/C17H20FN3O4/c1-17(2,3)13-8-15(25-21-13)20-14(22)9-19-12-7-10(16(23)24-4)5-6-11(12)18/h5-8,19H,9H2,1-4H3,(H,20,22)