4-[5-ethoxycarbonyl-3-(furan-2-yl)pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[5-ethoxycarbonyl-3-(furan-2-yl)pyrazol-1-yl]benzoic acid Openeye Name: 4-[5-ethoxycarbonyl-3-(2-furyl)pyrazol-1-yl]benzoic acid CAS Name: 4-[5-ethoxycarbonyl-3-(2-furanyl)-1-pyrazolyl]benzoic acid IUPAC Name: 4-[5-ethoxycarbonyl-3-(furan-2-yl)pyrazol-1-yl]benzoic acid Traditional Name: 4-[5-carbethoxy-3-(2-furyl)pyrazol-1-yl]benzoic acid Formula: C17H14N2O5 MolecularWeight: 326.30346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C2=CC=C(C=C2)C(=O)O)C3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C2=CC=C(C=C2)C(=O)O)C3=CC=CO3

InChI

InChI=1S/C17H14N2O5/c1-2-23-17(22)14-10-13(15-4-3-9-24-15)18-19(14)12-7-5-11(6-8-12)16(20)21/h3-10H,2H2,1H3,(H,20,21)