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4-[4-[chloro(difluoro)methoxy]anilino]-6-methoxy-3-quinolinecarboxylic acid ethyl ester
SpectraBase Compound ID IAnPQZFqMC8
InChI InChI=1S/C20H17ClF2N2O4/c1-3-28-19(26)16-11-24-17-9-8-14(27-2)10-15(17)18(16)25-12-4-6-13(7-5-12)29-20(21,22)23/h4-11H,3H2,1-2H3,(H,24,25)
InChIKey UUSPXZAVUFAEOT-UHFFFAOYSA-N
Mol Weight 422.82 g/mol
Molecular Formula C20H17ClF2N2O4
Exact Mass 422.084491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVrstlkrnRw
Name 4-[4-[chloro(difluoro)methoxy]anilino]-6-methoxy-3-quinolinecarboxylic acid ethyl ester
Alternate Name(s) 4-[4-[chloro(difluoro)methoxy]anilino]-6-methoxy-quinoline-3-carboxylic acid ethyl ester Ethyl 4-[4-[chloro(difluoro)methoxy]anilino]-6-methoxy-quinoline-3-carboxylate Ethyl 4-[[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]amino]-6-methoxy-quinoline-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17ClF2N2O4
InChI InChI=1S/C20H17ClF2N2O4/c1-3-28-19(26)16-11-24-17-9-8-14(27-2)10-15(17)18(16)25-12-4-6-13(7-5-12)29-20(21,22)23/h4-11H,3H2,1-2H3,(H,24,25)
InChIKey UUSPXZAVUFAEOT-UHFFFAOYSA-N
Molecular Weight 422.816 g/mol
SMILES N(c1c(C(=O)OCC)cnc2c1cc(cc2)OC)c1ccc(OC(F)(Cl)F)cc1
SPLASH splash10-009l-7986100000-8d438f8a607014be455c
Wiley ID 1457867