4-methyl-3-[3-[2-(methylamino)pyrimidin-4-yl]pyridin-2-yl]oxy-benzoic acid

Systemtic Name: 4-methyl-3-[3-[2-(methylamino)pyrimidin-4-yl]pyridin-2-yl]oxy-benzoic acid Openeye Name: 4-methyl-3-[[3-[2-(methylamino)pyrimidin-4-yl]-2-pyridyl]oxy]benzoic acid CAS Name: 4-methyl-3-[[3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl]oxy]benzoic acid IUPAC Name: 4-methyl-3-[3-[2-(methylamino)pyrimidin-4-yl]pyridin-2-yl]oxybenzoic acid Traditional Name: 4-methyl-3-[[3-[2-(methylamino)pyrimidin-4-yl]-2-pyridyl]oxy]benzoic acid Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)OC2=C(C=CC=N2)C3=NC(=NC=C3)NC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)OC2=C(C=CC=N2)C3=NC(=NC=C3)NC

InChI

InChI=1S/C18H16N4O3/c1-11-5-6-12(17(23)24)10-15(11)25-16-13(4-3-8-20-16)14-7-9-21-18(19-2)22-14/h3-10H,1-2H3,(H,23,24)(H,19,21,22)