3-[[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]-pyridin-3-ylcarbonyl-amino]benzoic acid

Systemtic Name: 3-[[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]-pyridin-3-ylcarbonyl-amino]benzoic acid Openeye Name: 3-[4-(difluoromethoxy)-3-ethoxy-N-(pyridine-3-carbonyl)anilino]benzoic acid CAS Name: 3-[4-(difluoromethoxy)-3-ethoxy-N-[oxo(3-pyridinyl)methyl]anilino]benzoic acid IUPAC Name: 3-[4-(difluoromethoxy)-3-ethoxy-N-(pyridine-3-carbonyl)anilino]benzoic acid Traditional Name: 3-[4-(difluoromethoxy)-3-ethoxy-N-nicotinoyl-anilino]benzoic acid Formula: C22H18F2N2O5 MolecularWeight: 428.385526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)N(C2=CC=CC(=C2)C(=O)O)C(=O)C3=CN=CC=C3)OC(F)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)N(C2=CC=CC(=C2)C(=O)O)C(=O)C3=CN=CC=C3)OC(F)F

InChI

InChI=1S/C22H18F2N2O5/c1-2-30-19-12-17(8-9-18(19)31-22(23)24)26(20(27)15-6-4-10-25-13-15)16-7-3-5-14(11-16)21(28)29/h3-13,22H,2H2,1H3,(H,28,29)