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STQ

Summary
Name:(1~{S})-1,2,3,4-tetrahydronaphthalen-1-amine
Formula:C10 H13 N
Formal charge:0
Formula weight:147.217 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(1~{S})-1,2,3,4-tetrahydronaphthalen-1-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7,11H2/t10-/m0/s1
InChIKeyInChI1.03JRZGPXSSNPTNMA-JTQLQIEISA-N
SMILES_CANONICALCACTVS3.385N[C@H]1CCCc2ccccc12
SMILESCACTVS3.385N[CH]1CCCc2ccccc12
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc2c(c1)CCC[C@@H]2N
SMILESOpenEye OEToolkits2.0.7c1ccc2c(c1)CCCC2N

221051

PDB entries from 2024-06-12

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