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Benzoic acid, 4-[[2-[3-(aminocarbonyl)-4-nitro-1H-pyrazol-1-yl]acetyl]amino]-, ethyl ester
SpectraBase Compound ID 1VnJT6SVNDh
InChI InChI=1S/C15H15N5O6/c1-2-26-15(23)9-3-5-10(6-4-9)17-12(21)8-19-7-11(20(24)25)13(18-19)14(16)22/h3-7H,2,8H2,1H3,(H2,16,22)(H,17,21)
InChIKey FWBZVOGEVVRMCG-UHFFFAOYSA-N
Mol Weight 361.31 g/mol
Molecular Formula C15H15N5O6
Exact Mass 361.102233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMRve4SJXvA
Name Benzoic acid, 4-[[2-[3-(aminocarbonyl)-4-nitro-1H-pyrazol-1-yl]acetyl]amino]-, ethyl ester
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Formula C15H15N5O6
InChI InChI=1S/C15H15N5O6/c1-2-26-15(23)9-3-5-10(6-4-9)17-12(21)8-19-7-11(20(24)25)13(18-19)14(16)22/h3-7H,2,8H2,1H3,(H2,16,22)(H,17,21)
InChIKey FWBZVOGEVVRMCG-UHFFFAOYSA-N
Molecular Weight 361.314 g/mol
SMILES N(c1ccc(cc1)C(OCC)=O)C(C[n]1nc(C(N)=O)c(c1)N(=O)=O)=O
SPLASH splash10-00di-3901000000-a4ffb3959d22f0c35bf6
Synonyms 4-[[2-(3-carbamoyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]benzoic acid ethyl ester 4-[[2-(3-carbamoyl-4-nitro-pyrazol-1-yl)acetyl]amino]benzoic acid ethyl ester Ethyl 4-[2-(3-aminocarbonyl-4-nitro-pyrazol-1-yl)ethanoylamino]benzoate Ethyl 4-[[2-(3-carbamoyl-4-nitro-pyrazol-1-yl)acetyl]amino]benzoate
Wiley ID 1448881