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5JW

Summary
Name:{[(2,7-dichloro-9H-fluoren-9-ylidene)amino]oxy}acetic acid
Formula:C15 H9 Cl2 N O3
Formal charge:0
Formula weight:322.143 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01{[(2,7-dichloro-9H-fluoren-9-ylidene)amino]oxy}acetic acid
OpenEye OEToolkits1.9.22-[[2,7-bis(chloranyl)fluoren-9-ylidene]amino]oxyethanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Clc2ccc3c1ccc(cc1C(\c3c2)=N/OCC(O)=O)Cl
InChIInChI1.03InChI=1S/C15H9Cl2NO3/c16-8-1-3-10-11-4-2-9(17)6-13(11)15(12(10)5-8)18-21-7-14(19)20/h1-6H,7H2,(H,19,20)
InChIKeyInChI1.03BZMUZKQLRPSKDP-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC(=O)CON=C1c2cc(Cl)ccc2c3ccc(Cl)cc13
SMILESCACTVS3.385OC(=O)CON=C1c2cc(Cl)ccc2c3ccc(Cl)cc13
SMILES_CANONICALOpenEye OEToolkits1.9.2c1cc-2c(cc1Cl)C(=NOCC(=O)O)c3c2ccc(c3)Cl
SMILESOpenEye OEToolkits1.9.2c1cc-2c(cc1Cl)C(=NOCC(=O)O)c3c2ccc(c3)Cl

219140

PDB entries from 2024-05-01

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