3-[1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-3-oxidanylidene-2-piperidin-2-yl-propanoic acid

Systemtic Name: 3-[1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-3-oxidanylidene-2-piperidin-2-yl-propanoic acid Openeye Name: 3-[1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-3-oxo-2-(2-piperidyl)propanoic acid CAS Name: 3-[1-(6-methoxy-3-pyridinyl)-5-phenyl-3-pyrazolyl]-3-oxo-2-(2-piperidinyl)propanoic acid IUPAC Name: 3-[1-(6-methoxypyridin-3-yl)-5-phenylpyrazol-3-yl]-3-oxo-2-piperidin-2-ylpropanoic acid Traditional Name: 3-keto-3-[1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-2-(2-piperidyl)propionic acid Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)C(C3CCCCN3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)C(C3CCCCN3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4O4/c1-31-20-11-10-16(14-25-20)27-19(15-7-3-2-4-8-15)13-18(26-27)22(28)21(23(29)30)17-9-5-6-12-24-17/h2-4,7-8,10-11,13-14,17,21,24H,5-6,9,12H2,1H3,(H,29,30)