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1-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]-4-phenyl-isonipecotic acid ethyl ester
SpectraBase Compound ID 6RcZq5iQMAl
InChI InChI=1S/C23H27ClN2O4/c1-3-30-22(28)23(17-7-5-4-6-8-17)11-13-26(14-12-23)16-21(27)25-19-15-18(24)9-10-20(19)29-2/h4-10,15H,3,11-14,16H2,1-2H3,(H,25,27)
InChIKey JBRWSEXKCQVTGY-UHFFFAOYSA-N
Mol Weight 430.93 g/mol
Molecular Formula C23H27ClN2O4
Exact Mass 430.165935 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DucK0ENTM2
Name 1-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]-4-phenyl-isonipecotic acid ethyl ester
Alternate Name(s) 1-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester Ethyl 1-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]-4-phenyl-piperidine-4-carboxylate Ethyl 1-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-4-carboxylate
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Formula C23H27ClN2O4
InChI InChI=1S/C23H27ClN2O4/c1-3-30-22(28)23(17-7-5-4-6-8-17)11-13-26(14-12-23)16-21(27)25-19-15-18(24)9-10-20(19)29-2/h4-10,15H,3,11-14,16H2,1-2H3,(H,25,27)
InChIKey JBRWSEXKCQVTGY-UHFFFAOYSA-N
Molecular Weight 430.932 g/mol
SMILES N(c1cc(Cl)ccc1OC)C(CN1CCC(C(=O)OCC)(CC1)c1ccccc1)=O
SPLASH splash10-0002-4490000000-53b63dc285f26df06fa2
Wiley ID 1460132