2-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]acetic acid CAS Name: 2-[4-[[4-[(1,3-dimethyl-4-pyrazolyl)methyl]-1-piperazinyl]-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]acetic acid Formula: C16H22N6O3 MolecularWeight: 346.38428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CN2CCN(CC2)C(=O)C3=CN(N=C3)CC(=O)O)C

Isomeric SMILES

CC1=NN(C=C1CN2CCN(CC2)C(=O)C3=CN(N=C3)CC(=O)O)C

InChI

InChI=1S/C16H22N6O3/c1-12-14(8-19(2)18-12)9-20-3-5-21(6-4-20)16(25)13-7-17-22(10-13)11-15(23)24/h7-8,10H,3-6,9,11H2,1-2H3,(H,23,24)