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UAB

Summary
Name:4-methyl-~{N}-(4-phenylbutyl)piperidine-1-carboxamide
Formula:C17 H26 N2 O
Formal charge:0
Formula weight:274.401 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.74-methyl-~{N}-(4-phenylbutyl)piperidine-1-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C17H26N2O/c1-15-10-13-19(14-11-15)17(20)18-12-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,15H,5-6,9-14H2,1H3,(H,18,20)
InChIKeyInChI1.03DHSRHSOXWFKTLE-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC1CCN(CC1)C(=O)NCCCCc2ccccc2
SMILESCACTVS3.385CC1CCN(CC1)C(=O)NCCCCc2ccccc2
SMILES_CANONICALOpenEye OEToolkits2.0.7CC1CCN(CC1)C(=O)NCCCCc2ccccc2
SMILESOpenEye OEToolkits2.0.7CC1CCN(CC1)C(=O)NCCCCc2ccccc2

222415

PDB entries from 2024-07-10

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