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

Systemtic Name: 3-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[[4-[(1,3-dimethyl-4-pyrazolyl)methyl]-1-piperazinyl]-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[4-[(1,3-dimethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propionic acid Formula: C17H24N6O3 MolecularWeight: 360.41086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N6O3/c1-13-15(10-20(2)19-13)11-21-5-7-22(8-6-21)17(26)14-9-18-23(12-14)4-3-16(24)25/h9-10,12H,3-8,11H2,1-2H3,(H,24,25)