1-methyl-3-(2,4,4-trimethylpentan-2-ylcarbamoyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-3-(2,4,4-trimethylpentan-2-ylcarbamoyl)pyrazole-4-carboxylic acid Openeye Name: 1-methyl-3-(1,1,3,3-tetramethylbutylcarbamoyl)pyrazole-4-carboxylic acid CAS Name: 1-methyl-3-[oxo-(2,4,4-trimethylpentan-2-ylamino)methyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-3-(2,4,4-trimethylpentan-2-ylcarbamoyl)pyrazole-4-carboxylic acid Traditional Name: 1-methyl-3-(1,1,3,3-tetramethylbutylcarbamoyl)pyrazole-4-carboxylic acid Formula: C14H23N3O3 MolecularWeight: 281.35072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=O)C1=NN(C=C1C(=O)O)C

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=O)C1=NN(C=C1C(=O)O)C

InChI

InChI=1S/C14H23N3O3/c1-13(2,3)8-14(4,5)15-11(18)10-9(12(19)20)7-17(6)16-10/h7H,8H2,1-6H3,(H,15,18)(H,19,20)