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

Systemtic Name: 1-methyl-3-(propan-2-ylcarbamoyl)pyrazole-4-carboxylic acid Openeye Name: 3-(isopropylcarbamoyl)-1-methyl-pyrazole-4-carboxylic acid CAS Name: 1-methyl-3-[oxo-(propan-2-ylamino)methyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-3-(propan-2-ylcarbamoyl)pyrazole-4-carboxylic acid Traditional Name: 3-(isopropylcarbamoyl)-1-methyl-pyrazole-4-carboxylic acid Formula: C9H13N3O3 MolecularWeight: 211.21782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13N3O3/c1-5(2)10-8(13)7-6(9(14)15)4-12(3)11-7/h4-5H,1-3H3,(H,10,13)(H,14,15)