(2-tert-butylpyrimidin-5-yl)-[4-(2-methylphenyl)-4-oxidanyl-piperidin-1-yl]methanone

Systemtic Name: (2-tert-butylpyrimidin-5-yl)-[4-(2-methylphenyl)-4-oxidanyl-piperidin-1-yl]methanone Openeye Name: (2-tert-butylpyrimidin-5-yl)-[4-hydroxy-4-(o-tolyl)-1-piperidyl]methanone CAS Name: (2-tert-butyl-5-pyrimidinyl)-[4-hydroxy-4-(2-methylphenyl)-1-piperidinyl]methanone IUPAC Name: (2-tert-butylpyrimidin-5-yl)-[4-hydroxy-4-(2-methylphenyl)piperidin-1-yl]methanone Traditional Name: (2-tert-butylpyrimidin-5-yl)-[4-hydroxy-4-(o-tolyl)piperidino]methanone Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2(CCN(CC2)C(=O)C3=CN=C(N=C3)C(C)(C)C)O

Isomeric SMILES

CC1=CC=CC=C1C2(CCN(CC2)C(=O)C3=CN=C(N=C3)C(C)(C)C)O

InChI

InChI=1S/C21H27N3O2/c1-15-7-5-6-8-17(15)21(26)9-11-24(12-10-21)18(25)16-13-22-19(23-14-16)20(2,3)4/h5-8,13-14,26H,9-12H2,1-4H3