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4-Methoxy-3-([3-(4-nitrophenyl)-3-oxopropanoyl]amino)benzoic acid
SpectraBase Compound ID CLybQQX38E6
InChI InChI=1S/C17H14N2O7/c1-26-15-7-4-11(17(22)23)8-13(15)18-16(21)9-14(20)10-2-5-12(6-3-10)19(24)25/h2-8H,9H2,1H3,(H,18,21)(H,22,23)
InChIKey OYKCKTQKFSGCGY-UHFFFAOYSA-N
Mol Weight 358.31 g/mol
Molecular Formula C17H14N2O7
Exact Mass 358.080101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJSWzzvMLb5
Name 4-Methoxy-3-([3-(4-nitrophenyl)-3-oxopropanoyl]amino)benzoic acid
CAS Registry Number 79073-33-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O7
InChI InChI=1S/C17H14N2O7/c1-26-15-7-4-11(17(22)23)8-13(15)18-16(21)9-14(20)10-2-5-12(6-3-10)19(24)25/h2-8H,9H2,1H3,(H,18,21)(H,22,23)
InChIKey OYKCKTQKFSGCGY-UHFFFAOYSA-N
Molecular Weight 358.306 g/mol
SMILES N(C(=O)CC(c1ccc(cc1)N(=O)=O)=O)c1c(ccc(C(O)=O)c1)OC
SPLASH splash10-0gb9-3900000000-2e976eb45ac35582b05f
Synonyms 3-[[3-keto-3-(4-nitrophenyl)propanoyl]amino]-4-methoxy-benzoic acid 4-Methoxy-3-[3-(4-nitro-phenyl)-3-oxo-propionylamino]-benzoic acid 4-Methoxy-3-[[3-(4-nitrophenyl)-1,3-dioxopropyl]amino]benzoic acid 4-Methoxy-3-[[3-(4-nitrophenyl)-3-oxidanylidene-propanoyl]amino]benzoic acid 4-Methoxy-3-[[3-(4-nitrophenyl)-3-oxopropanoyl]amino]benzoic acid
Wiley ID 1460518