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GH6

Summary
Name:2-[[2,6-bis(chloranyl)-3-phenylmethoxy-phenyl]amino]pyridine-3-carboxylic acid
Formula:C19 H14 Cl2 N2 O3
Formal charge:0
Formula weight:389.232 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.72-[[2,6-bis(chloranyl)-3-phenylmethoxy-phenyl]amino]pyridine-3-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C19H14Cl2N2O3/c20-14-8-9-15(26-11-12-5-2-1-3-6-12)16(21)17(14)23-18-13(19(24)25)7-4-10-22-18/h1-10H,11H2,(H,22,23)(H,24,25)
InChIKeyInChI1.03AYGDOYFDJDUPSS-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC(=O)c1cccnc1Nc2c(Cl)ccc(OCc3ccccc3)c2Cl
SMILESCACTVS3.385OC(=O)c1cccnc1Nc2c(Cl)ccc(OCc3ccccc3)c2Cl
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)COc2ccc(c(c2Cl)Nc3c(cccn3)C(=O)O)Cl
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)COc2ccc(c(c2Cl)Nc3c(cccn3)C(=O)O)Cl

222415

数据于2024-07-10公开中

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