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3AB

Summary
Name:3-aminobenzamide
Formula:C7 H8 N2 O
Formal charge:0
Formula weight:136.151 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043-aminobenzamide
OpenEye OEToolkits1.5.03-aminobenzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(c1cc(N)ccc1)N
SMILES_CANONICALCACTVS3.341NC(=O)c1cccc(N)c1
SMILESCACTVS3.341NC(=O)c1cccc(N)c1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(cc(c1)N)C(=O)N
SMILESOpenEye OEToolkits1.5.0c1cc(cc(c1)N)C(=O)N
InChIInChI1.03InChI=1S/C7H8N2O/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H2,9,10)
InChIKeyInChI1.03GSCPDZHWVNUUFI-UHFFFAOYSA-N

218500

PDB entries from 2024-04-17

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