2-[2-[(3R)-5-phenyl-2-(phenylcarbonyl)-3,4-dihydropyrazol-3-yl]phenoxy]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-[(3R)-5-phenyl-2-(phenylcarbonyl)-3,4-dihydropyrazol-3-yl]phenoxy]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-[(3R)-2-benzoyl-5-phenyl-3,4-dihydropyrazol-3-yl]phenoxy]-1-(1-piperidyl)ethanone CAS Name: 2-[2-[(3R)-2-benzoyl-5-phenyl-3,4-dihydropyrazol-3-yl]phenoxy]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-[(3R)-2-benzoyl-5-phenyl-3,4-dihydropyrazol-3-yl]phenoxy]-1-piperidin-1-ylethanone Traditional Name: 2-[2-[(3R)-2-benzoyl-5-phenyl-2-pyrazolin-3-yl]phenoxy]-1-piperidino-ethanone Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC2=CC=CC=C2C3CC(=NN3C(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)COC2=CC=CC=C2[C@H]3CC(=NN3C(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H29N3O3/c33-28(31-18-10-3-11-19-31)21-35-27-17-9-8-16-24(27)26-20-25(22-12-4-1-5-13-22)30-32(26)29(34)23-14-6-2-7-15-23/h1-2,4-9,12-17,26H,3,10-11,18-21H2/t26-/m1/s1