4-[[8-(2-fluoranyl-4-methylsulfonyl-phenyl)-1,7-naphthyridin-4-yl]oxy]piperidine-1-carboxylic acid

Systemtic Name: 4-[[8-(2-fluoranyl-4-methylsulfonyl-phenyl)-1,7-naphthyridin-4-yl]oxy]piperidine-1-carboxylic acid Openeye Name: 4-[[8-(2-fluoro-4-methylsulfonyl-phenyl)-1,7-naphthyridin-4-yl]oxy]piperidine-1-carboxylic acid CAS Name: 4-[[8-(2-fluoro-4-methylsulfonylphenyl)-1,7-naphthyridin-4-yl]oxy]-1-piperidinecarboxylic acid IUPAC Name: 4-[[8-(2-fluoro-4-methylsulfonylphenyl)-1,7-naphthyridin-4-yl]oxy]piperidine-1-carboxylic acid Traditional Name: 4-[[8-(2-fluoro-4-mesyl-phenyl)-1,7-naphthyridin-4-yl]oxy]piperidine-1-carboxylic acid Formula: C21H20FN3O5S MolecularWeight: 445.464003

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C2=NC=CC3=C(C=CN=C32)OC4CCN(CC4)C(=O)O)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)C2=NC=CC3=C(C=CN=C32)OC4CCN(CC4)C(=O)O)F

InChI

InChI=1S/C21H20FN3O5S/c1-31(28,29)14-2-3-15(17(22)12-14)19-20-16(4-8-23-19)18(5-9-24-20)30-13-6-10-25(11-7-13)21(26)27/h2-5,8-9,12-13H,6-7,10-11H2,1H3,(H,26,27)