3,5-dimethyl-1-[2-(methylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-[2-(methylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-[2-(methylamino)-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[2-(methylamino)-2-oxoethyl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-[2-(methylamino)-2-oxoethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(methylamino)ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C9H13N3O3 MolecularWeight: 211.21782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC)C)C(=O)O

InChI

InChI=1S/C9H13N3O3/c1-5-8(9(14)15)6(2)12(11-5)4-7(13)10-3/h4H2,1-3H3,(H,10,13)(H,14,15)