Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

AIE

Summary
Name:3-ethanoyl-N-phenyl-benzamide
Synonyms:AKOS000277907
Formula:C15 H13 N O2
Formal charge:0
Formula weight:239.269 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.73-ethanoyl-~{N}-phenyl-benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C15H13NO2/c1-11(17)12-6-5-7-13(10-12)15(18)16-14-8-3-2-4-9-14/h2-10H,1H3,(H,16,18)
InChIKeyInChI1.06TUZSKGRYUUDVTC-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(=O)c1cccc(c1)C(=O)Nc2ccccc2
SMILESCACTVS3.385CC(=O)c1cccc(c1)C(=O)Nc2ccccc2
SMILES_CANONICALOpenEye OEToolkits2.0.7CC(=O)c1cccc(c1)C(=O)Nc2ccccc2
SMILESOpenEye OEToolkits2.0.7CC(=O)c1cccc(c1)C(=O)Nc2ccccc2

221716

PDB entries from 2024-06-26

PDB statisticsPDBj update infoContact PDBjnumon