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({2-[4-(Benzoylaminomethyl)-5-methyl-3-phenylpyrazol-1-yl]ethyl}methoxycarbonylmethylamino)acetic acid methyl ester
SpectraBase Compound ID 7zFWfyIprqO
InChI InChI=1S/C26H30N4O5/c1-19-22(16-27-26(33)21-12-8-5-9-13-21)25(20-10-6-4-7-11-20)28-30(19)15-14-29(17-23(31)34-2)18-24(32)35-3/h4-13H,14-18H2,1-3H3,(H,27,33)
InChIKey LNWHHGHBGCJIRY-UHFFFAOYSA-N
Mol Weight 478.55 g/mol
Molecular Formula C26H30N4O5
Exact Mass 478.22162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lYjDyuijEa
Name ({2-[4-(Benzoylaminomethyl)-5-methyl-3-phenylpyrazol-1-yl]ethyl}methoxycarbonylmethylamino)acetic acid methyl ester
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Formula C26H30N4O5
InChI InChI=1S/C26H30N4O5/c1-19-22(16-27-26(33)21-12-8-5-9-13-21)25(20-10-6-4-7-11-20)28-30(19)15-14-29(17-23(31)34-2)18-24(32)35-3/h4-13H,14-18H2,1-3H3,(H,27,33)
InChIKey LNWHHGHBGCJIRY-UHFFFAOYSA-N
Molecular Weight 478.549 g/mol
SMILES N(C(=O)c1ccccc1)Cc1c(n[n](c1C)CCN(CC(=O)OC)CC(=O)OC)-c1ccccc1
SPLASH splash10-056r-2900000000-da357115c5167a30650f
Source of Spectrum O1-60-172-4
Synonyms Methyl[(2-{4-[(benzoylamino)methyl]-5-methyl-3-phenyl-1H-pyrazol-1-yl}ethyl)(2-methoxy-2-oxoethyl)amino]acetate
Wiley ID 1591964