5-tert-butyl-1-(3,4-dimethylphenyl)pyrazole-3-carboxylate

Systemtic Name: 5-tert-butyl-1-(3,4-dimethylphenyl)pyrazole-3-carboxylate Openeye Name: 5-tert-butyl-1-(3,4-dimethylphenyl)pyrazole-3-carboxylate CAS Name: 5-tert-butyl-1-(3,4-dimethylphenyl)-3-pyrazolecarboxylate IUPAC Name: 5-tert-butyl-1-(3,4-dimethylphenyl)pyrazole-3-carboxylate Traditional Name: 5-tert-butyl-1-(3,4-dimethylphenyl)pyrazole-3-carboxylate Formula: C16H19N2O2- MolecularWeight: 271.33426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)[O-])C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)[O-])C(C)(C)C)C

InChI

InChI=1S/C16H20N2O2/c1-10-6-7-12(8-11(10)2)18-14(16(3,4)5)9-13(17-18)15(19)20/h6-9H,1-5H3,(H,19,20)/p-1