2-[(5S)-5-(cyclohexylcarbamoyl)-3-(4-fluorophenyl)-4H-1,2-oxazol-5-yl]ethanoate

Systemtic Name: 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(4-fluorophenyl)-4H-1,2-oxazol-5-yl]ethanoate Openeye Name: 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(4-fluorophenyl)-4H-isoxazol-5-yl]acetate CAS Name: 2-[(5S)-5-[(cyclohexylamino)-oxomethyl]-3-(4-fluorophenyl)-4H-isoxazol-5-yl]acetate IUPAC Name: 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(4-fluorophenyl)-4H-1,2-oxazol-5-yl]acetate Traditional Name: 2-[(5S)-5-(cyclohexylcarbamoyl)-3-(4-fluorophenyl)-2-isoxazolin-5-yl]acetate Formula: C18H20FN2O4- MolecularWeight: 347.360803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2(CC(=NO2)C3=CC=C(C=C3)F)CC(=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)[C@]2(CC(=NO2)C3=CC=C(C=C3)F)CC(=O)[O-]

InChI

InChI=1S/C18H21FN2O4/c19-13-8-6-12(7-9-13)15-10-18(25-21-15,11-16(22)23)17(24)20-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H,20,24)(H,22,23)/p-1/t18-/m0/s1