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DP4

Summary
Name:(1s,4s)-4-[dimethyl(phenyl)silyl]-1-methylpiperidine 1-oxide
Formula:C14 H23 N O Si
Formal charge:0
Formula weight:249.424 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(1s,4s)-4-[dimethyl(phenyl)silyl]-1-methylpiperidine 1-oxide
OpenEye OEToolkits1.7.0dimethyl-(1-methyl-1-oxidanidyl-piperidin-1-ium-4-yl)-phenyl-silane

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01[O-][N+]2(CCC([Si](c1ccccc1)(C)C)CC2)C
SMILES_CANONICALCACTVS3.370C[N@+]1([O-])CC[C@H](CC1)[Si](C)(C)c2ccccc2
SMILESCACTVS3.370C[N+]1([O-])CC[CH](CC1)[Si](C)(C)c2ccccc2
SMILES_CANONICALOpenEye OEToolkits1.7.0C[N+]1(CCC(CC1)[Si](C)(C)c2ccccc2)[O-]
SMILESOpenEye OEToolkits1.7.0C[N+]1(CCC(CC1)[Si](C)(C)c2ccccc2)[O-]
InChIInChI1.03InChI=1S/C14H23NOSi/c1-15(16)11-9-14(10-12-15)17(2,3)13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3/t14-,15+
InChIKeyInChI1.03HDJXTRKZEHHECC-GASCZTMLSA-N

218853

PDB entries from 2024-04-24

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