3,5-dimethyl-1-[1-(2-methylbutan-2-ylamino)-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-[1-(2-methylbutan-2-ylamino)-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-(1,1-dimethylpropylamino)-1-methyl-2-oxo-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-(tert-amylamino)-2-keto-1-methyl-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C14H23N3O3 MolecularWeight: 281.35072

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C)N1C(=C(C(=N1)C)C(=O)O)C

Isomeric SMILES

CCC(C)(C)NC(=O)C(C)N1C(=C(C(=N1)C)C(=O)O)C

InChI

InChI=1S/C14H23N3O3/c1-7-14(5,6)15-12(18)10(4)17-9(3)11(13(19)20)8(2)16-17/h10H,7H2,1-6H3,(H,15,18)(H,19,20)