5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonyl-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonyl-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[4-[(1-ethyl-4-pyrazolyl)methyl]-1-piperazinyl]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[4-[(1-ethylpyrazol-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:

CCN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=C(C=NN3C)C(=O)O

Isomeric SMILES

CCN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=C(C=NN3C)C(=O)O

InChI

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