3-[(3,5-dimethylpyrazol-1-yl)methyl]-1-benzofuran-2-carboxylate

Systemtic Name: 3-[(3,5-dimethylpyrazol-1-yl)methyl]-1-benzofuran-2-carboxylate Openeye Name: 3-[(3,5-dimethylpyrazol-1-yl)methyl]benzofuran-2-carboxylate CAS Name: 3-[(3,5-dimethyl-1-pyrazolyl)methyl]-2-benzofurancarboxylate IUPAC Name: 3-[(3,5-dimethylpyrazol-1-yl)methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[(3,5-dimethylpyrazol-1-yl)methyl]coumarilate Formula: C15H13N2O3- MolecularWeight: 269.27532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C(OC3=CC=CC=C32)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1CC2=C(OC3=CC=CC=C32)C(=O)[O-])C

InChI

InChI=1S/C15H14N2O3/c1-9-7-10(2)17(16-9)8-12-11-5-3-4-6-13(11)20-14(12)15(18)19/h3-7H,8H2,1-2H3,(H,18,19)/p-1