5-methyl-3-(2,4,4-trimethylpentan-2-ylamino)-1H-pyrazole-4-carboxylic acid

Systemtic Name: 5-methyl-3-(2,4,4-trimethylpentan-2-ylamino)-1H-pyrazole-4-carboxylic acid Openeye Name: 5-methyl-3-(1,1,3,3-tetramethylbutylamino)-1H-pyrazole-4-carboxylic acid CAS Name: 5-methyl-3-(2,4,4-trimethylpentan-2-ylamino)-1H-pyrazole-4-carboxylic acid IUPAC Name: 5-methyl-3-(2,4,4-trimethylpentan-2-ylamino)-1H-pyrazole-4-carboxylic acid Traditional Name: 5-methyl-3-(1,1,3,3-tetramethylbutylamino)-1H-pyrazole-4-carboxylic acid Formula: C13H23N3O2 MolecularWeight: 253.34062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)NC(C)(C)CC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)NC(C)(C)CC(C)(C)C)C(=O)O

InChI

InChI=1S/C13H23N3O2/c1-8-9(11(17)18)10(16-15-8)14-13(5,6)7-12(2,3)4/h7H2,1-6H3,(H,17,18)(H2,14,15,16)