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L18

Summary
Name:(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine
Formula:C18 H29 N
Formal charge:0
Formula weight:259.43 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenylpentyl]piperidine
OpenEye OEToolkits1.5.0(1R,2S)-1-methyl-2-[(2S,4R)-2-methyl-4-phenyl-pentyl]piperidine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04c1ccccc1C(C)CC(CC2N(C)CCCC2)C
SMILES_CANONICALCACTVS3.341C[C@@H](C[C@@H](C)c1ccccc1)C[C@@H]2CCCCN2C
SMILESCACTVS3.341C[CH](C[CH](C)c1ccccc1)C[CH]2CCCCN2C
SMILES_CANONICALOpenEye OEToolkits1.5.0C[C@H](C[C@@H]1CCCC[N@]1C)C[C@@H](C)c2ccccc2
SMILESOpenEye OEToolkits1.5.0CC(CC1CCCCN1C)CC(C)c2ccccc2
InChIInChI1.03InChI=1S/C18H29N/c1-15(14-18-11-7-8-12-19(18)3)13-16(2)17-9-5-4-6-10-17/h4-6,9-10,15-16,18H,7-8,11-14H2,1-3H3/t15-,16+,18-/m0/s1
InChIKeyInChI1.03UEEAJOUBQAEABH-JZXOWHBKSA-N

225399

PDB entries from 2024-09-25

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