2-[5-(butan-2-ylcarbamoyl)-3-(4-fluorophenyl)-4H-1,2-oxazol-5-yl]ethanoic acid

Systemtic Name: 2-[5-(butan-2-ylcarbamoyl)-3-(4-fluorophenyl)-4H-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[3-(4-fluorophenyl)-5-(sec-butylcarbamoyl)-4H-isoxazol-5-yl]acetic acid CAS Name: 2-[5-[(butan-2-ylamino)-oxomethyl]-3-(4-fluorophenyl)-4H-isoxazol-5-yl]acetic acid IUPAC Name: 2-[5-(butan-2-ylcarbamoyl)-3-(4-fluorophenyl)-4H-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-[3-(4-fluorophenyl)-5-(sec-butylcarbamoyl)-2-isoxazolin-5-yl]acetic acid Formula: C16H19FN2O4 MolecularWeight: 322.331463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1(CC(=NO1)C2=CC=C(C=C2)F)CC(=O)O

Isomeric SMILES

CCC(C)NC(=O)C1(CC(=NO1)C2=CC=C(C=C2)F)CC(=O)O

InChI

InChI=1S/C16H19FN2O4/c1-3-10(2)18-15(22)16(9-14(20)21)8-13(19-23-16)11-4-6-12(17)7-5-11/h4-7,10H,3,8-9H2,1-2H3,(H,18,22)(H,20,21)