4-[1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-1,4-oxazepan-5-one

Systemtic Name: 4-[1-(6-methoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-1,4-oxazepan-5-one Openeye Name: 4-[1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-1,4-oxazepan-5-one CAS Name: 4-[1-(6-methoxy-3-pyridinyl)-5-phenyl-3-pyrazolyl]-1,4-oxazepan-5-one IUPAC Name: 4-[1-(6-methoxypyridin-3-yl)-5-phenylpyrazol-3-yl]-1,4-oxazepan-5-one Traditional Name: 4-[1-(6-methoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-1,4-oxazepan-5-one Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=N2)N3CCOCCC3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=N2)N3CCOCCC3=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O3/c1-26-19-8-7-16(14-21-19)24-17(15-5-3-2-4-6-15)13-18(22-24)23-10-12-27-11-9-20(23)25/h2-8,13-14H,9-12H2,1H3