6-(1,3-dimethylpyrazol-4-yl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate

Systemtic Name: 6-(1,3-dimethylpyrazol-4-yl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate Openeye Name: 6-(1,3-dimethylpyrazol-4-yl)-3-phenyl-isoxazolo[5,4-b]pyridine-4-carboxylate CAS Name: 6-(1,3-dimethyl-4-pyrazolyl)-3-phenyl-4-isoxazolo[5,4-b]pyridinecarboxylate IUPAC Name: 6-(1,3-dimethylpyrazol-4-yl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylate Traditional Name: 6-(1,3-dimethylpyrazol-4-yl)-3-phenyl-isoxazolo[5,4-b]pyridine-4-carboxylate Formula: C18H13N4O3- MolecularWeight: 333.32082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC3=C(C(=C2)C(=O)[O-])C(=NO3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C=C1C2=NC3=C(C(=C2)C(=O)[O-])C(=NO3)C4=CC=CC=C4)C

InChI

InChI=1S/C18H14N4O3/c1-10-13(9-22(2)20-10)14-8-12(18(23)24)15-16(21-25-17(15)19-14)11-6-4-3-5-7-11/h3-9H,1-2H3,(H,23,24)/p-1