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4-Chloro-N-(2-cyano-4,5-diethoxy-phenyl)-3-nitro-benzamide
SpectraBase Compound ID LMIAmvtzHD2
InChI InChI=1S/C18H16ClN3O5/c1-3-26-16-8-12(10-20)14(9-17(16)27-4-2)21-18(23)11-5-6-13(19)15(7-11)22(24)25/h5-9H,3-4H2,1-2H3,(H,21,23)
InChIKey AZFHRHQTCMSMRN-UHFFFAOYSA-N
Mol Weight 389.8 g/mol
Molecular Formula C18H16ClN3O5
Exact Mass 389.077848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jb8fHAaLO0y
Name 4-Chloro-N-(2-cyano-4,5-diethoxy-phenyl)-3-nitro-benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16ClN3O5
InChI InChI=1S/C18H16ClN3O5/c1-3-26-16-8-12(10-20)14(9-17(16)27-4-2)21-18(23)11-5-6-13(19)15(7-11)22(24)25/h5-9H,3-4H2,1-2H3,(H,21,23)
InChIKey AZFHRHQTCMSMRN-UHFFFAOYSA-N
Molecular Weight 389.795 g/mol
SMILES N(c1c(C#N)cc(c(c1)OCC)OCC)C(c1cc(N(=O)=O)c(cc1)Cl)=O
SPLASH splash10-001r-1901000000-6f5eaf24872e5d2106f9
Synonyms 4-Chloranyl-N-(2-cyano-4,5-diethoxy-phenyl)-3-nitro-benzamide
Wiley ID 1511465