3-(2,5-dimethylfuran-3-yl)-1-pyrimidin-2-yl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(2,5-dimethylfuran-3-yl)-1-pyrimidin-2-yl-pyrazole-4-carboxylic acid Openeye Name: 3-(2,5-dimethyl-3-furyl)-1-pyrimidin-2-yl-pyrazole-4-carboxylic acid CAS Name: 3-(2,5-dimethyl-3-furanyl)-1-(2-pyrimidinyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-(2,5-dimethylfuran-3-yl)-1-pyrimidin-2-ylpyrazole-4-carboxylic acid Traditional Name: 3-(2,5-dimethyl-3-furyl)-1-(2-pyrimidyl)pyrazole-4-carboxylic acid Formula: C14H12N4O3 MolecularWeight: 284.27008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C2=NN(C=C2C(=O)O)C3=NC=CC=N3

Isomeric SMILES

CC1=CC(=C(O1)C)C2=NN(C=C2C(=O)O)C3=NC=CC=N3

InChI

InChI=1S/C14H12N4O3/c1-8-6-10(9(2)21-8)12-11(13(19)20)7-18(17-12)14-15-4-3-5-16-14/h3-7H,1-2H3,(H,19,20)