3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate Openeye Name: 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate IUPAC Name: 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-tert-butylphenyl)-1H-pyrazole-5-carboxylate Formula: C14H15N2O2- MolecularWeight: 243.2811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O2/c1-14(2,3)10-6-4-9(5-7-10)11-8-12(13(17)18)16-15-11/h4-8H,1-3H3,(H,15,16)(H,17,18)/p-1