3-[4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonyl-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-[4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonyl-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-[4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-[[4-[(1,5-dimethyl-4-pyrazolyl)methyl]-1-piperazinyl]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-[4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-[4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C16H22N6O3 MolecularWeight: 346.38428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CN2CCN(CC2)C(=O)C3=NN(C=C3C(=O)O)C

Isomeric SMILES

CC1=C(C=NN1C)CN2CCN(CC2)C(=O)C3=NN(C=C3C(=O)O)C

InChI

InChI=1S/C16H22N6O3/c1-11-12(8-17-20(11)3)9-21-4-6-22(7-5-21)15(23)14-13(16(24)25)10-19(2)18-14/h8,10H,4-7,9H2,1-3H3,(H,24,25)