3-[[3-(3-fluoranylpyridin-4-yl)-5-methyl-1,2-oxazol-4-yl]carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 3-[[3-(3-fluoranylpyridin-4-yl)-5-methyl-1,2-oxazol-4-yl]carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 3-[[3-(3-fluoro-4-pyridyl)-5-methyl-isoxazole-4-carbonyl]amino]cyclohexanecarboxylic acid CAS Name: 3-[[[3-(3-fluoro-4-pyridinyl)-5-methyl-4-isoxazolyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 3-[[3-(3-fluoropyridin-4-yl)-5-methyl-1,2-oxazole-4-carbonyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 3-[[3-(3-fluoro-4-pyridyl)-5-methyl-isoxazole-4-carbonyl]amino]cyclohexanecarboxylic acid Formula: C17H18FN3O4 MolecularWeight: 347.340923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=NC=C2)F)C(=O)NC3CCCC(C3)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=NC=C2)F)C(=O)NC3CCCC(C3)C(=O)O

InChI

InChI=1S/C17H18FN3O4/c1-9-14(15(21-25-9)12-5-6-19-8-13(12)18)16(22)20-11-4-2-3-10(7-11)17(23)24/h5-6,8,10-11H,2-4,7H2,1H3,(H,20,22)(H,23,24)