3-(1-benzofuran-3-yl)-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(1-benzofuran-3-yl)-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-(benzofuran-3-yl)-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-(3-benzofuranyl)-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(1-benzofuran-3-yl)-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-(benzofuran-3-yl)-1-methyl-pyrazole-4-carboxylic acid Formula: C13H10N2O3 MolecularWeight: 242.2301

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=COC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CN1C=C(C(=N1)C2=COC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C13H10N2O3/c1-15-6-9(13(16)17)12(14-15)10-7-18-11-5-3-2-4-8(10)11/h2-7H,1H3,(H,16,17)