2-(2,2-dimethylpropanoylamino)-3-(3-fluoranylpyridin-4-yl)-6-methoxy-benzoic acid

Systemtic Name: 2-(2,2-dimethylpropanoylamino)-3-(3-fluoranylpyridin-4-yl)-6-methoxy-benzoic acid Openeye Name: 2-(2,2-dimethylpropanoylamino)-3-(3-fluoro-4-pyridyl)-6-methoxy-benzoic acid CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-3-(3-fluoro-4-pyridinyl)-6-methoxybenzoic acid IUPAC Name: 2-(2,2-dimethylpropanoylamino)-3-(3-fluoropyridin-4-yl)-6-methoxybenzoic acid Traditional Name: 3-(3-fluoro-4-pyridyl)-6-methoxy-2-(pivaloylamino)benzoic acid Formula: C18H19FN2O4 MolecularWeight: 346.352863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=CC(=C1C(=O)O)OC)C2=C(C=NC=C2)F

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=CC(=C1C(=O)O)OC)C2=C(C=NC=C2)F

InChI

InChI=1S/C18H19FN2O4/c1-18(2,3)17(24)21-15-11(10-7-8-20-9-12(10)19)5-6-13(25-4)14(15)16(22)23/h5-9H,1-4H3,(H,21,24)(H,22,23)