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

Systemtic Name: 3,5-dimethyl-1-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(4-methylpiperazino)ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCN(CC2)C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCN(CC2)C)C)C(=O)O

InChI

InChI=1S/C13H20N4O3/c1-9-12(13(19)20)10(2)17(14-9)8-11(18)16-6-4-15(3)5-7-16/h4-8H2,1-3H3,(H,19,20)