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4-[4-(4-hydroxy-3-methoxy-5-nitro-benzylidene)-3-methyl-5-oxo-4,5-dihydro-pyrazol-1-yl]-benzenesulfonamide
SpectraBase Compound ID KW3ITAW1wLw
InChI InChI=1S/C18H16N4O7S/c1-10-14(7-11-8-15(22(25)26)17(23)16(9-11)29-2)18(24)21(20-10)12-3-5-13(6-4-12)30(19,27)28/h3-9,23H,1-2H3,(H2,19,27,28)/b14-7+
InChIKey MXFXQFORNRTZEJ-VGOFMYFVSA-N
Mol Weight 432.41 g/mol
Molecular Formula C18H16N4O7S
Exact Mass 432.07397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B41eUVqYR7I
Name 4-[4-(4-hydroxy-3-methoxy-5-nitro-benzylidene)-3-methyl-5-oxo-4,5-dihydro-pyrazol-1-yl]-benzenesulfonamide
Alternate Name(s) 4-[(4E)-4-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzenesulfonamide 4-[4-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N4O7S
InChI InChI=1S/C18H16N4O7S/c1-10-14(7-11-8-15(22(25)26)17(23)16(9-11)29-2)18(24)21(20-10)12-3-5-13(6-4-12)30(19,27)28/h3-9,23H,1-2H3,(H2,19,27,28)/b14-7+
InChIKey MXFXQFORNRTZEJ-VGOFMYFVSA-N
Molecular Weight 432.407 g/mol
SMILES NS(c1ccc(N2C(\C(=C\c3cc(c(c(c3)N(=O)=O)O)OC)C(=N2)C)=O)cc1)(=O)=O
SPLASH splash10-03di-1194200000-a985bc7af75575ad59c9
Wiley ID 1454870