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

Systemtic Name: 3-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-oxoethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]piperazino]propionic acid Formula: C14H22N4O3 MolecularWeight: 294.34948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O3/c1-10-12(11(2)16-15-10)9-13(19)18-7-5-17(6-8-18)4-3-14(20)21/h3-9H2,1-2H3,(H,15,16)(H,20,21)