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9AH

Summary
Name:4-(dipropylamino)butanenitrile
Formula:C10 H20 N2
Formal charge:0
Formula weight:168.279 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-(dipropylamino)butanenitrile

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H20N2/c1-3-8-12(9-4-2)10-6-5-7-11/h3-6,8-10H2,1-2H3
InChIKeyInChI1.03FLJPZKPNJVGMHO-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCN(CCC)CCCC#N
SMILESCACTVS3.385CCCN(CCC)CCCC#N
SMILES_CANONICALOpenEye OEToolkits2.0.6CCCN(CCC)CCCC#N
SMILESOpenEye OEToolkits2.0.6CCCN(CCC)CCCC#N

217705

PDB entries from 2024-03-27

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