4-[1-[4-(3,5-dimethyl-4-oxidanyl-phenyl)carbonylpyridin-2-yl]piperidin-4-yl]-2-phenyl-1H-pyrazol-5-one

Systemtic Name: 4-[1-[4-(3,5-dimethyl-4-oxidanyl-phenyl)carbonylpyridin-2-yl]piperidin-4-yl]-2-phenyl-1H-pyrazol-5-one Openeye Name: 4-[1-[4-(4-hydroxy-3,5-dimethyl-benzoyl)-2-pyridyl]-4-piperidyl]-2-phenyl-1H-pyrazol-5-one CAS Name: 4-[1-[4-[(4-hydroxy-3,5-dimethylphenyl)-oxomethyl]-2-pyridinyl]-4-piperidinyl]-2-phenyl-1H-pyrazol-5-one IUPAC Name: 4-[1-[4-(4-hydroxy-3,5-dimethylbenzoyl)pyridin-2-yl]piperidin-4-yl]-2-phenyl-1H-pyrazol-5-one Traditional Name: 4-[1-[4-(4-hydroxy-3,5-dimethyl-benzoyl)-2-pyridyl]-4-piperidyl]-1-phenyl-3-pyrazolin-3-one Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C(=O)C2=CC(=NC=C2)N3CCC(CC3)C4=CN(NC4=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C(=O)C2=CC(=NC=C2)N3CCC(CC3)C4=CN(NC4=O)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3/c1-18-14-22(15-19(2)26(18)33)27(34)21-8-11-29-25(16-21)31-12-9-20(10-13-31)24-17-32(30-28(24)35)23-6-4-3-5-7-23/h3-8,11,14-17,20,33H,9-10,12-13H2,1-2H3,(H,30,35)