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TLK

Summary
Name:3-methoxy-4-(2-phenylimidazol-1-yl)benzaldehyde
Formula:C17 H14 N2 O2
Formal charge:0
Formula weight:278.305 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.73-methoxy-4-(2-phenylimidazol-1-yl)benzaldehyde

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C17H14N2O2/c1-21-16-11-13(12-20)7-8-15(16)19-10-9-18-17(19)14-5-3-2-4-6-14/h2-12H,1H3
InChIKeyInChI1.03VPVOFFUNHDIJQI-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1cc(C=O)ccc1n2ccnc2c3ccccc3
SMILESCACTVS3.385COc1cc(C=O)ccc1n2ccnc2c3ccccc3
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1cc(ccc1n2ccnc2c3ccccc3)C=O
SMILESOpenEye OEToolkits2.0.7COc1cc(ccc1n2ccnc2c3ccccc3)C=O

222415

PDB entries from 2024-07-10

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