2-[4-(1,3,5-trimethylpyrazol-4-yl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(1,3,5-trimethylpyrazol-4-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(1,3,5-trimethylpyrazole-4-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[oxo-(1,3,5-trimethyl-4-pyrazolyl)methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(1,3,5-trimethylpyrazole-4-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(1,3,5-trimethylpyrazole-4-carbonyl)piperazino]acetic acid Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C13H20N4O3/c1-9-12(10(2)15(3)14-9)13(20)17-6-4-16(5-7-17)8-11(18)19/h4-8H2,1-3H3,(H,18,19)