5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid CAS Name: 5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(1,3-benzodioxol-5-ylmethoxy)-1,3-dimethylpyrazole-4-carboxylic acid Traditional Name: 1,3-dimethyl-5-piperonyloxy-pyrazole-4-carboxylic acid Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)OCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)OCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C14H14N2O5/c1-8-12(14(17)18)13(16(2)15-8)19-6-9-3-4-10-11(5-9)21-7-20-10/h3-5H,6-7H2,1-2H3,(H,17,18)