(2-tert-butylpyrimidin-5-yl)-[3-(2-methoxyphenyl)-3-oxidanyl-piperidin-1-yl]methanone

Systemtic Name: (2-tert-butylpyrimidin-5-yl)-[3-(2-methoxyphenyl)-3-oxidanyl-piperidin-1-yl]methanone Openeye Name: (2-tert-butylpyrimidin-5-yl)-[3-hydroxy-3-(2-methoxyphenyl)-1-piperidyl]methanone CAS Name: (2-tert-butyl-5-pyrimidinyl)-[3-hydroxy-3-(2-methoxyphenyl)-1-piperidinyl]methanone IUPAC Name: (2-tert-butylpyrimidin-5-yl)-[3-hydroxy-3-(2-methoxyphenyl)piperidin-1-yl]methanone Traditional Name: (2-tert-butylpyrimidin-5-yl)-[3-hydroxy-3-(2-methoxyphenyl)piperidino]methanone Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(C=N1)C(=O)N2CCCC(C2)(C3=CC=CC=C3OC)O

Isomeric SMILES

CC(C)(C)C1=NC=C(C=N1)C(=O)N2CCCC(C2)(C3=CC=CC=C3OC)O

InChI

InChI=1S/C21H27N3O3/c1-20(2,3)19-22-12-15(13-23-19)18(25)24-11-7-10-21(26,14-24)16-8-5-6-9-17(16)27-4/h5-6,8-9,12-13,26H,7,10-11,14H2,1-4H3