3-[2-(6-methoxypyridin-3-yl)-5-piperidin-1-ylcarbonyl-pyrazol-3-yl]pyridine-4-carboxylic acid

Systemtic Name: 3-[2-(6-methoxypyridin-3-yl)-5-piperidin-1-ylcarbonyl-pyrazol-3-yl]pyridine-4-carboxylic acid Openeye Name: 3-[2-(6-methoxy-3-pyridyl)-5-(piperidine-1-carbonyl)pyrazol-3-yl]pyridine-4-carboxylic acid CAS Name: 3-[2-(6-methoxy-3-pyridinyl)-5-[oxo(1-piperidinyl)methyl]-3-pyrazolyl]-4-pyridinecarboxylic acid IUPAC Name: 3-[2-(6-methoxypyridin-3-yl)-5-(piperidine-1-carbonyl)pyrazol-3-yl]pyridine-4-carboxylic acid Traditional Name: 3-[2-(6-methoxy-3-pyridyl)-5-(piperidine-1-carbonyl)pyrazol-3-yl]isonicotinic acid Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCCCC3)C4=C(C=CN=C4)C(=O)O

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCCCC3)C4=C(C=CN=C4)C(=O)O

InChI

InChI=1S/C21H21N5O4/c1-30-19-6-5-14(12-23-19)26-18(16-13-22-8-7-15(16)21(28)29)11-17(24-26)20(27)25-9-3-2-4-10-25/h5-8,11-13H,2-4,9-10H2,1H3,(H,28,29)