1-[(5S)-3-methyl-5-oxidanyl-5-pyridin-3-yl-4H-pyrazol-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[(5S)-3-methyl-5-oxidanyl-5-pyridin-3-yl-4H-pyrazol-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[(5S)-5-hydroxy-3-methyl-5-(3-pyridyl)-4H-pyrazol-1-yl]-2-phenoxy-ethanone CAS Name: 1-[(5S)-5-hydroxy-3-methyl-5-(3-pyridinyl)-4H-pyrazol-1-yl]-2-phenoxyethanone IUPAC Name: 1-[(5S)-5-hydroxy-3-methyl-5-pyridin-3-yl-4H-pyrazol-1-yl]-2-phenoxyethanone Traditional Name: 1-[(5S)-5-hydroxy-3-methyl-5-(3-pyridyl)-2-pyrazolin-1-yl]-2-phenoxy-ethanone Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C2=CN=CC=C2)O)C(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=NN([C@](C1)(C2=CN=CC=C2)O)C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C17H17N3O3/c1-13-10-17(22,14-6-5-9-18-11-14)20(19-13)16(21)12-23-15-7-3-2-4-8-15/h2-9,11,22H,10,12H2,1H3/t17-/m0/s1