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GWV

Summary
Name:~{N},~{N}-dimethyl-4-[(propan-2-ylamino)methyl]aniline
Formula:C12 H20 N2
Formal charge:0
Formula weight:192.301 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6~{N},~{N}-dimethyl-4-[(propan-2-ylamino)methyl]aniline

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C12H20N2/c1-10(2)13-9-11-5-7-12(8-6-11)14(3)4/h5-8,10,13H,9H2,1-4H3
InChIKeyInChI1.03NZXPKDJRJFKEIC-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(C)NCc1ccc(cc1)N(C)C
SMILESCACTVS3.385CC(C)NCc1ccc(cc1)N(C)C
SMILES_CANONICALOpenEye OEToolkits2.0.6CC(C)NCc1ccc(cc1)N(C)C
SMILESOpenEye OEToolkits2.0.6CC(C)NCc1ccc(cc1)N(C)C

221371

PDB entries from 2024-06-19

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