3-(3,5-dimethyl-1-prop-2-enyl-pyrazol-4-yl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(3,5-dimethyl-1-prop-2-enyl-pyrazol-4-yl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(1-allyl-3,5-dimethyl-pyrazol-4-yl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(3,5-dimethyl-1-prop-2-enyl-4-pyrazolyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(3,5-dimethyl-1-prop-2-enylpyrazol-4-yl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(1-allyl-3,5-dimethyl-pyrazol-4-yl)-1H-pyrazole-5-carboxylic acid Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC=C)C)C2=NNC(=C2)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC=C)C)C2=NNC(=C2)C(=O)O

InChI

InChI=1S/C12H14N4O2/c1-4-5-16-8(3)11(7(2)15-16)9-6-10(12(17)18)14-13-9/h4,6H,1,5H2,2-3H3,(H,13,14)(H,17,18)