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

Systemtic Name: 3-[4-(1,3,5-trimethylpyrazol-4-yl)carbonylpiperazin-1-yl]propanoic acid Openeye Name: 3-[4-(1,3,5-trimethylpyrazole-4-carbonyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[oxo-(1,3,5-trimethyl-4-pyrazolyl)methyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(1,3,5-trimethylpyrazole-4-carbonyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(1,3,5-trimethylpyrazole-4-carbonyl)piperazino]propionic acid Formula: C14H22N4O3 MolecularWeight: 294.34948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O3/c1-10-13(11(2)16(3)15-10)14(21)18-8-6-17(7-9-18)5-4-12(19)20/h4-9H2,1-3H3,(H,19,20)