3-[5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]propanoic acid

Systemtic Name: 3-[5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]propanoic acid Openeye Name: 3-[5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[5-[[4-[(1-ethyl-4-pyrazolyl)methyl]-1-piperazinyl]-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[5-[4-[(1-ethylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propionic acid Formula: C17H24N6O3 MolecularWeight: 360.41086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=CC=NN3CCC(=O)O

Isomeric SMILES

CCN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=CC=NN3CCC(=O)O

InChI

InChI=1S/C17H24N6O3/c1-2-22-13-14(11-19-22)12-20-7-9-21(10-8-20)17(26)15-3-5-18-23(15)6-4-16(24)25/h3,5,11,13H,2,4,6-10,12H2,1H3,(H,24,25)