2-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-oxoethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]piperazino]acetic acid Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CC(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=C(C(=NN1)C)CC(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C13H20N4O3/c1-9-11(10(2)15-14-9)7-12(18)17-5-3-16(4-6-17)8-13(19)20/h3-8H2,1-2H3,(H,14,15)(H,19,20)