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N3R

Summary
Name:5-fluoro-N-[2-(2-methoxyphenoxy)ethyl]-2-oxo-1,2-dihydroquinoline-4-carboxamide
Formula:C19 H17 F N2 O4
Formal charge:0
Formula weight:356.348 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.015-fluoro-N-[2-(2-methoxyphenoxy)ethyl]-2-oxo-1,2-dihydroquinoline-4-carboxamide
OpenEye OEToolkits2.0.75-fluoranyl-~{N}-[2-(2-methoxyphenoxy)ethyl]-2-oxidanylidene-1~{H}-quinoline-4-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01COc1ccccc1OCCNC(=O)C1=CC(=O)Nc2cccc(F)c21
InChIInChI1.06InChI=1S/C19H17FN2O4/c1-25-15-7-2-3-8-16(15)26-10-9-21-19(24)12-11-17(23)22-14-6-4-5-13(20)18(12)14/h2-8,11H,9-10H2,1H3,(H,21,24)(H,22,23)
InChIKeyInChI1.06HLMOMNRZAYBAJZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccccc1OCCNC(=O)C2=CC(=O)Nc3cccc(F)c23
SMILESCACTVS3.385COc1ccccc1OCCNC(=O)C2=CC(=O)Nc3cccc(F)c23
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1ccccc1OCCNC(=O)C2=CC(=O)Nc3c2c(ccc3)F
SMILESOpenEye OEToolkits2.0.7COc1ccccc1OCCNC(=O)C2=CC(=O)Nc3c2c(ccc3)F

218853

PDB entries from 2024-04-24

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