3-(3,4-dimethylphenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: 3-(3,4-dimethylphenyl)-1H-pyrazole-5-carboxylate Openeye Name: 3-(3,4-dimethylphenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(3,4-dimethylphenyl)-1H-pyrazole-5-carboxylate IUPAC Name: 3-(3,4-dimethylphenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(3,4-dimethylphenyl)-1H-pyrazole-5-carboxylate Formula: C12H11N2O2- MolecularWeight: 215.22794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)[O-])C

InChI

InChI=1S/C12H12N2O2/c1-7-3-4-9(5-8(7)2)10-6-11(12(15)16)14-13-10/h3-6H,1-2H3,(H,13,14)(H,15,16)/p-1