C2A

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Summary

Name:1-(3-CHLOROPHENYL)METHANAMINE
Synonyms:INHIBITOR OF THROMBIN
Formula:C7 H8 Cl N
Formal charge:0
Molecular weight:141.598 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.041-(3-chlorophenyl)methanamine
OpenEye OEToolkits1.5.0(3-chlorophenyl)methanamine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Clc1cc(ccc1)CN
SMILES_CANONICALCACTVS3.341NCc1cccc(Cl)c1
SMILESCACTVS3.341NCc1cccc(Cl)c1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(cc(c1)Cl)CN
SMILESOpenEye OEToolkits1.5.0c1cc(cc(c1)Cl)CN
InChIInChI1.03InChI=1S/C7H8ClN/c8-7-3-1-2-6(4-7)5-9/h1-4H,5,9H2
InChIKeyInChI1.03BJFPYGGTDAYECS-UHFFFAOYSA-N