1-methyl-5-phenylmethoxy-pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-5-phenylmethoxy-pyrazole-4-carboxylic acid Openeye Name: 5-benzyloxy-1-methyl-pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-phenylmethoxy-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-phenylmethoxypyrazole-4-carboxylic acid Traditional Name: 5-benzoxy-1-methyl-pyrazole-4-carboxylic acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)OCC2=CC=CC=C2

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)OCC2=CC=CC=C2

InChI

InChI=1S/C12H12N2O3/c1-14-11(10(7-13-14)12(15)16)17-8-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,15,16)