4-[(4-methoxycarbonylpyrazol-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(4-methoxycarbonylpyrazol-1-yl)methyl]benzoic acid Openeye Name: 4-[(4-methoxycarbonylpyrazol-1-yl)methyl]benzoic acid CAS Name: 4-[(4-methoxycarbonyl-1-pyrazolyl)methyl]benzoic acid IUPAC Name: 4-[(4-methoxycarbonylpyrazol-1-yl)methyl]benzoic acid Traditional Name: 4-[(4-carbomethoxypyrazol-1-yl)methyl]benzoic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=C1)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

COC(=O)C1=CN(N=C1)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H12N2O4/c1-19-13(18)11-6-14-15(8-11)7-9-2-4-10(5-3-9)12(16)17/h2-6,8H,7H2,1H3,(H,16,17)