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58Z

Summary
Name:1-[2-(1H-indol-5-yloxy)ethyl]piperidine-4-carboxylic acid
Formula:C16 H20 N2 O3
Formal charge:0
Formula weight:288.342 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.041-[2-(1H-indol-5-yloxy)ethyl]piperidine-4-carboxylic acid
OpenEye OEToolkits1.5.01-[2-(1H-indol-5-yloxy)ethyl]piperidine-4-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)C3CCN(CCOc2cc1ccnc1cc2)CC3
SMILES_CANONICALCACTVS3.341OC(=O)C1CCN(CCOc2ccc3[nH]ccc3c2)CC1
SMILESCACTVS3.341OC(=O)C1CCN(CCOc2ccc3[nH]ccc3c2)CC1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc2c(cc[nH]2)cc1OCCN3CCC(CC3)C(=O)O
SMILESOpenEye OEToolkits1.5.0c1cc2c(cc[nH]2)cc1OCCN3CCC(CC3)C(=O)O
InChIInChI1.03InChI=1S/C16H20N2O3/c19-16(20)12-4-7-18(8-5-12)9-10-21-14-1-2-15-13(11-14)3-6-17-15/h1-3,6,11-12,17H,4-5,7-10H2,(H,19,20)
InChIKeyInChI1.03WEUOMMCSMCVWHD-UHFFFAOYSA-N

218853

PDB entries from 2024-04-24

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