1-[2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]pyrazole-3-carboxylic acid Openeye Name: 1-[2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-2-oxo-ethyl]pyrazole-3-carboxylic acid CAS Name: 1-[2-[4-[(1-methyl-4-pyrazolyl)methyl]-1-piperazinyl]-2-oxoethyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-2-oxoethyl]pyrazole-3-carboxylic acid Traditional Name: 1-[2-keto-2-[4-[(1-methylpyrazol-4-yl)methyl]piperazino]ethyl]pyrazole-3-carboxylic acid Formula: C15H20N6O3 MolecularWeight: 332.3577

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CCN(CC2)C(=O)CN3C=CC(=N3)C(=O)O

Isomeric SMILES

CN1C=C(C=N1)CN2CCN(CC2)C(=O)CN3C=CC(=N3)C(=O)O

InChI

InChI=1S/C15H20N6O3/c1-18-9-12(8-16-18)10-19-4-6-20(7-5-19)14(22)11-21-3-2-13(17-21)15(23)24/h2-3,8-9H,4-7,10-11H2,1H3,(H,23,24)