2-methyl-4-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]carbonyl-pyrazole-3-carboxylic acid

Systemtic Name: 2-methyl-4-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]carbonyl-pyrazole-3-carboxylic acid Openeye Name: 2-methyl-4-[4-[(1-methylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazole-3-carboxylic acid CAS Name: 2-methyl-4-[[4-[(1-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-oxomethyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-methyl-4-[4-[(1-methylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazole-3-carboxylic acid Traditional Name: 2-methyl-4-[4-[(1-methylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazole-3-carboxylic acid Formula: C15H20N6O3 MolecularWeight: 332.3577

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=C(N(N=C3)C)C(=O)O

Isomeric SMILES

CN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=C(N(N=C3)C)C(=O)O

InChI

InChI=1S/C15H20N6O3/c1-18-9-11(7-16-18)10-20-3-5-21(6-4-20)14(22)12-8-17-19(2)13(12)15(23)24/h7-9H,3-6,10H2,1-2H3,(H,23,24)