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LEZ

Summary
Name:~{N}-[(3-chlorophenyl)methyl]-1-(1~{H}-indol-3-ylmethyl)piperidin-4-amine
Formula:C21 H24 Cl N3
Formal charge:0
Formula weight:353.888 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-[(3-chlorophenyl)methyl]-1-(1~{H}-indol-3-ylmethyl)piperidin-4-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C21H24ClN3/c22-18-5-3-4-16(12-18)13-23-19-8-10-25(11-9-19)15-17-14-24-21-7-2-1-6-20(17)21/h1-7,12,14,19,23-24H,8-11,13,15H2
InChIKeyInChI1.03ZBFRXMWMJAMISF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Clc1cccc(CNC2CCN(CC2)Cc3c[nH]c4ccccc34)c1
SMILESCACTVS3.385Clc1cccc(CNC2CCN(CC2)Cc3c[nH]c4ccccc34)c1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc2c(c1)c(c[nH]2)CN3CCC(CC3)NCc4cccc(c4)Cl
SMILESOpenEye OEToolkits2.0.7c1ccc2c(c1)c(c[nH]2)CN3CCC(CC3)NCc4cccc(c4)Cl

222624

數據於2024-07-17公開中

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