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

Systemtic Name: 3,5-dimethyl-1-[1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-(isopropylamino)-1-methyl-2-oxo-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[1-oxo-1-(propan-2-ylamino)propan-2-yl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-[1-oxo-1-(propan-2-ylamino)propan-2-yl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-(isopropylamino)-2-keto-1-methyl-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C12H19N3O3 MolecularWeight: 253.29756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NC(C)C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NC(C)C)C)C(=O)O

InChI

InChI=1S/C12H19N3O3/c1-6(2)13-11(16)9(5)15-8(4)10(12(17)18)7(3)14-15/h6,9H,1-5H3,(H,13,16)(H,17,18)