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

Systemtic Name: 3-(5-methylfuran-2-yl)-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-(5-methyl-2-furyl)-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-(5-methyl-2-furanyl)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(5-methylfuran-2-yl)-1-phenylpyrazole-4-carboxylic acid Traditional Name: 3-(5-methyl-2-furyl)-1-phenyl-pyrazole-4-carboxylic acid Formula: C15H12N2O3 MolecularWeight: 268.26738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O3/c1-10-7-8-13(20-10)14-12(15(18)19)9-17(16-14)11-5-3-2-4-6-11/h2-9H,1H3,(H,18,19)