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2-(1-Benzyl-4,5-dimethylimidazol-2-yl)-2-(3-nitrophenyl)propionic acid N-(3-chloro-4-methoxyphenyl)amide
SpectraBase Compound ID 6Bl4DW9oMCH
InChI InChI=1S/C28H27ClN4O4/c1-18-19(2)32(17-20-9-6-5-7-10-20)26(30-18)28(3,21-11-8-12-23(15-21)33(35)36)27(34)31-22-13-14-25(37-4)24(29)16-22/h5-16H,17H2,1-4H3,(H,31,34)
InChIKey UKZJDWVJWUGEBL-UHFFFAOYSA-N
Mol Weight 519.0 g/mol
Molecular Formula C28H27ClN4O4
Exact Mass 518.172083 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bk7UEoBxrN
Name 2-(1-Benzyl-4,5-dimethylimidazol-2-yl)-2-(3-nitrophenyl)propionic acid N-(3-chloro-4-methoxyphenyl)amide
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Formula C28H27ClN4O4
InChI InChI=1S/C28H27ClN4O4/c1-18-19(2)32(17-20-9-6-5-7-10-20)26(30-18)28(3,21-11-8-12-23(15-21)33(35)36)27(34)31-22-13-14-25(37-4)24(29)16-22/h5-16H,17H2,1-4H3,(H,31,34)
InChIKey UKZJDWVJWUGEBL-UHFFFAOYSA-N
Molecular Weight 519.001 g/mol
SMILES N(C(C(c1nc(c([n]1Cc1ccccc1)C)C)(c1cccc(c1)[N+](=O)[O-])C)=O)c1ccc(c(c1)Cl)OC
SPLASH splash10-0006-6297000000-3eb96b0fd602054b6848
Source of Spectrum F5-13-9872/SM12-10f
Synonyms 2-(1-benzyl-4,5-dimethyl-1H-imidazol-2-yl)-N-(3-chloro-4-methoxyphenyl)-2-(3-nitrophenyl)propanamide
Wiley ID 1802003