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N4L

概要
表記:N-[2-(2-methoxyphenoxy)ethyl]-5-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
組成式:C20 H20 N2 O4
電荷:0
化学式量:352.384 Da
分子種別:non-polymer

化合物名

プログラムバージョン表記
ACDLabs12.01N-[2-(2-methoxyphenoxy)ethyl]-5-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
OpenEye OEToolkits2.0.7~{N}-[2-(2-methoxyphenoxy)ethyl]-5-methyl-2-oxidanylidene-1~{H}-quinoline-4-carboxamide

化合物記述子(線形表記)

種別プログラムバージョン表記
SMILESACDLabs12.01COc1ccccc1OCCNC(=O)C1=CC(=O)Nc2cccc(C)c21
InChIInChI1.06InChI=1S/C20H20N2O4/c1-13-6-5-7-15-19(13)14(12-18(23)22-15)20(24)21-10-11-26-17-9-4-3-8-16(17)25-2/h3-9,12H,10-11H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyInChI1.06FVKXXNFROYGAEF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccccc1OCCNC(=O)C2=CC(=O)Nc3cccc(C)c23
SMILESCACTVS3.385COc1ccccc1OCCNC(=O)C2=CC(=O)Nc3cccc(C)c23
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1cccc2c1C(=CC(=O)N2)C(=O)NCCOc3ccccc3OC
SMILESOpenEye OEToolkits2.0.7Cc1cccc2c1C(=CC(=O)N2)C(=O)NCCOc3ccccc3OC

222926

件を2024-07-24に公開中

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