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

Systemtic Name: 3-(2,5-dimethylfuran-3-yl)-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-(2,5-dimethyl-3-furyl)-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-(2,5-dimethyl-3-furanyl)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(2,5-dimethylfuran-3-yl)-1-phenylpyrazole-4-carboxylic acid Traditional Name: 3-(2,5-dimethyl-3-furyl)-1-phenyl-pyrazole-4-carboxylic acid Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O3/c1-10-8-13(11(2)21-10)15-14(16(19)20)9-18(17-15)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,19,20)