1-tert-butyl-5-chloranyl-3-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-tert-butyl-5-chloranyl-3-methyl-pyrazole-4-carboxylic acid Openeye Name: 1-tert-butyl-5-chloro-3-methyl-pyrazole-4-carboxylic acid CAS Name: 1-tert-butyl-5-chloro-3-methyl-4-pyrazolecarboxylic acid IUPAC Name: 1-tert-butyl-5-chloro-3-methylpyrazole-4-carboxylic acid Traditional Name: 1-tert-butyl-5-chloro-3-methyl-pyrazole-4-carboxylic acid Formula: C9H13ClN2O2 MolecularWeight: 216.66472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)Cl)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)Cl)C(C)(C)C

InChI

InChI=1S/C9H13ClN2O2/c1-5-6(8(13)14)7(10)12(11-5)9(2,3)4/h1-4H3,(H,13,14)