3-[[4-methoxy-3-(oxolan-2-yloxy)phenyl]-pyridin-4-ylcarbonyl-amino]benzoic acid

Systemtic Name: 3-[[4-methoxy-3-(oxolan-2-yloxy)phenyl]-pyridin-4-ylcarbonyl-amino]benzoic acid Openeye Name: 3-[4-methoxy-N-(pyridine-4-carbonyl)-3-tetrahydrofuran-2-yloxy-anilino]benzoic acid CAS Name: 3-[4-methoxy-3-(2-oxolanyloxy)-N-[oxo(pyridin-4-yl)methyl]anilino]benzoic acid IUPAC Name: 3-[4-methoxy-3-(oxolan-2-yloxy)-N-(pyridine-4-carbonyl)anilino]benzoic acid Traditional Name: 3-[N-isonicotinoyl-4-methoxy-3-(tetrahydrofuryloxy)anilino]benzoic acid Formula: C24H22N2O6 MolecularWeight: 434.44128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(C2=CC=CC(=C2)C(=O)O)C(=O)C3=CC=NC=C3)OC4CCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)N(C2=CC=CC(=C2)C(=O)O)C(=O)C3=CC=NC=C3)OC4CCCO4

InChI

InChI=1S/C24H22N2O6/c1-30-20-8-7-19(15-21(20)32-22-6-3-13-31-22)26(23(27)16-9-11-25-12-10-16)18-5-2-4-17(14-18)24(28)29/h2,4-5,7-12,14-15,22H,3,6,13H2,1H3,(H,28,29)