NHE

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Summary

Name:2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID
Synonyms:N-CYCLOHEXYLTAURINE
CHES
Formula:C8 H17 N O3 S
Formal charge:0
Molecular weight:207.29 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-(cyclohexylamino)ethanesulfonic acid
OpenEye OEToolkits1.5.02-(cyclohexylamino)ethanesulfonic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=S(=O)(O)CCNC1CCCCC1
SMILES_CANONICALCACTVS3.341O[S](=O)(=O)CCNC1CCCCC1
SMILESCACTVS3.341O[S](=O)(=O)CCNC1CCCCC1
SMILES_CANONICALOpenEye OEToolkits1.5.0C1CCC(CC1)NCCS(=O)(=O)O
SMILESOpenEye OEToolkits1.5.0C1CCC(CC1)NCCS(=O)(=O)O
InChIInChI1.03InChI=1S/C8H17NO3S/c10-13(11,12)7-6-9-8-4-2-1-3-5-8/h8-9H,1-7H2,(H,10,11,12)
InChIKeyInChI1.03MKWKNSIESPFAQN-UHFFFAOYSA-N
170172
PDB entries from 2020-10-21