5-cyclopropyl-2-[[2-(3-fluoranylpyridin-4-yl)pyridin-3-yl]amino]benzoic acid

Systemtic Name: 5-cyclopropyl-2-[[2-(3-fluoranylpyridin-4-yl)pyridin-3-yl]amino]benzoic acid Openeye Name: 5-cyclopropyl-2-[[2-(3-fluoro-4-pyridyl)-3-pyridyl]amino]benzoic acid CAS Name: 5-cyclopropyl-2-[[2-(3-fluoro-4-pyridinyl)-3-pyridinyl]amino]benzoic acid IUPAC Name: 5-cyclopropyl-2-[[2-(3-fluoropyridin-4-yl)pyridin-3-yl]amino]benzoic acid Traditional Name: 5-cyclopropyl-2-[[2-(3-fluoro-4-pyridyl)-3-pyridyl]amino]benzoic acid Formula: C20H16FN3O2 MolecularWeight: 349.358343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=C(C=C2)NC3=C(N=CC=C3)C4=C(C=NC=C4)F)C(=O)O

Isomeric SMILES

C1CC1C2=CC(=C(C=C2)NC3=C(N=CC=C3)C4=C(C=NC=C4)F)C(=O)O

InChI

InChI=1S/C20H16FN3O2/c21-16-11-22-9-7-14(16)19-18(2-1-8-23-19)24-17-6-5-13(12-3-4-12)10-15(17)20(25)26/h1-2,5-12,24H,3-4H2,(H,25,26)