2-[1-(6-methoxypyridin-3-yl)-5-pyridin-2-yl-pyrazol-3-yl]carbonylpiperazine-1-carboxylic acid

Systemtic Name: 2-[1-(6-methoxypyridin-3-yl)-5-pyridin-2-yl-pyrazol-3-yl]carbonylpiperazine-1-carboxylic acid Openeye Name: 2-[1-(6-methoxy-3-pyridyl)-5-(2-pyridyl)pyrazole-3-carbonyl]piperazine-1-carboxylic acid CAS Name: 2-[[1-(6-methoxy-3-pyridinyl)-5-(2-pyridinyl)-3-pyrazolyl]-oxomethyl]-1-piperazinecarboxylic acid IUPAC Name: 2-[1-(6-methoxypyridin-3-yl)-5-pyridin-2-ylpyrazole-3-carbonyl]piperazine-1-carboxylic acid Traditional Name: 2-[1-(6-methoxy-3-pyridyl)-5-(2-pyridyl)pyrazole-3-carbonyl]piperazine-1-carboxylic acid Formula: C20H20N6O4 MolecularWeight: 408.4106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)C3CNCCN3C(=O)O)C4=CC=CC=N4

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)C3CNCCN3C(=O)O)C4=CC=CC=N4

InChI

InChI=1S/C20H20N6O4/c1-30-18-6-5-13(11-23-18)26-16(14-4-2-3-7-22-14)10-15(24-26)19(27)17-12-21-8-9-25(17)20(28)29/h2-7,10-11,17,21H,8-9,12H2,1H3,(H,28,29)