3-(3-ethyl-1-benzofuran-2-yl)-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-(3-ethyl-1-benzofuran-2-yl)-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-(3-ethylbenzofuran-2-yl)-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-(3-ethyl-2-benzofuranyl)-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(3-ethyl-1-benzofuran-2-yl)-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-(3-ethylbenzofuran-2-yl)-1-methyl-pyrazole-4-carboxylic acid Formula: C15H14N2O3 MolecularWeight: 270.28326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC2=CC=CC=C21)C3=NN(C=C3C(=O)O)C

Isomeric SMILES

CCC1=C(OC2=CC=CC=C21)C3=NN(C=C3C(=O)O)C

InChI

InChI=1S/C15H14N2O3/c1-3-9-10-6-4-5-7-12(10)20-14(9)13-11(15(18)19)8-17(2)16-13/h4-8H,3H2,1-2H3,(H,18,19)