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0Q6

Summary
Name:4-[(3-bromophenyl)methoxy]benzamide
Formula:C14 H12 Br N O2
Formal charge:0
Formula weight:306.155 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.74-[(3-bromophenyl)methoxy]benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C14H12BrNO2/c15-12-3-1-2-10(8-12)9-18-13-6-4-11(5-7-13)14(16)17/h1-8H,9H2,(H2,16,17)
InChIKeyInChI1.03WNYIDDKTEYNPSM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NC(=O)c1ccc(OCc2cccc(Br)c2)cc1
SMILESCACTVS3.385NC(=O)c1ccc(OCc2cccc(Br)c2)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(cc(c1)Br)COc2ccc(cc2)C(=O)N
SMILESOpenEye OEToolkits2.0.7c1cc(cc(c1)Br)COc2ccc(cc2)C(=O)N

222415

PDB entries from 2024-07-10

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