2-(6-methoxypyridin-3-yl)-3-(4-phenylmethoxyphenyl)-1H-pyrazol-5-one

Systemtic Name: 2-(6-methoxypyridin-3-yl)-3-(4-phenylmethoxyphenyl)-1H-pyrazol-5-one Openeye Name: 3-(4-benzyloxyphenyl)-2-(6-methoxy-3-pyridyl)-1H-pyrazol-5-one CAS Name: 2-(6-methoxy-3-pyridinyl)-3-(4-phenylmethoxyphenyl)-1H-pyrazol-5-one IUPAC Name: 2-(6-methoxypyridin-3-yl)-3-(4-phenylmethoxyphenyl)-1H-pyrazol-5-one Traditional Name: 5-(4-benzoxyphenyl)-1-(6-methoxy-3-pyridyl)-3-pyrazolin-3-one Formula: C22H19N3O3 MolecularWeight: 373.40456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=CC(=O)N2)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=CC(=O)N2)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H19N3O3/c1-27-22-12-9-18(14-23-22)25-20(13-21(26)24-25)17-7-10-19(11-8-17)28-15-16-5-3-2-4-6-16/h2-14H,15H2,1H3,(H,24,26)