3-[3-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]propanoate

Systemtic Name: 3-[3-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]carbonylpyrazol-1-yl]propanoate Openeye Name: 3-[3-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propanoate CAS Name: 3-[3-[[4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-oxomethyl]-1-pyrazolyl]propanoate IUPAC Name: 3-[3-[4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propanoate Traditional Name: 3-[3-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazine-1-carbonyl]pyrazol-1-yl]propionate Formula: C18H25N6O3- MolecularWeight: 373.4295

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C3=NN(C=C3)CCC(=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C3=NN(C=C3)CCC(=O)[O-]

InChI

InChI=1S/C18H26N6O3/c1-3-23-13-15(14(2)19-23)12-21-8-10-22(11-9-21)18(27)16-4-6-24(20-16)7-5-17(25)26/h4,6,13H,3,5,7-12H2,1-2H3,(H,25,26)/p-1