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Summary
Name:N-(6-AMINOHEXYL)-5-CHLORO-1-NAPHTHALENESULFONAMIDE
Formula:C16 H21 Cl N2 O2 S
Formal charge:0
Formula weight:340.868 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04N-(6-aminohexyl)-5-chloronaphthalene-1-sulfonamide
OpenEye OEToolkits1.5.0N-(6-aminohexyl)-5-chloro-naphthalene-1-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=S(=O)(c1cccc2c1cccc2Cl)NCCCCCCN
SMILES_CANONICALCACTVS3.341NCCCCCCN[S](=O)(=O)c1cccc2c(Cl)cccc12
SMILESCACTVS3.341NCCCCCCN[S](=O)(=O)c1cccc2c(Cl)cccc12
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc2c(cccc2Cl)c(c1)S(=O)(=O)NCCCCCCN
SMILESOpenEye OEToolkits1.5.0c1cc2c(cccc2Cl)c(c1)S(=O)(=O)NCCCCCCN
InChIInChI1.03InChI=1S/C16H21ClN2O2S/c17-15-9-5-8-14-13(15)7-6-10-16(14)22(20,21)19-12-4-2-1-3-11-18/h5-10,19H,1-4,11-12,18H2
InChIKeyInChI1.03IDEHCMNLNCJQST-UHFFFAOYSA-N

224572

數據於2024-09-04公開中

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