2-[3-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]ethanoic acid Openeye Name: 2-[3-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]acetic acid CAS Name: 2-[3-[[4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[3-[4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[3-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]acetic acid Formula: C17H24N6O3 MolecularWeight: 360.41086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N6O3/c1-3-22-11-14(13(2)18-22)10-20-6-8-21(9-7-20)17(26)15-4-5-23(19-15)12-16(24)25/h4-5,11H,3,6-10,12H2,1-2H3,(H,24,25)