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1H-Pyrazole-1-acetic acid, 3-methyl-5-[[(2-oxo-2H-1-benzopyran-3-yl)carbonyl]amino]-, ethyl ester
SpectraBase Compound ID LnrLTlI1W5E
InChI InChI=1S/C18H17N3O5/c1-3-25-16(22)10-21-15(8-11(2)20-21)19-17(23)13-9-12-6-4-5-7-14(12)26-18(13)24/h4-9H,3,10H2,1-2H3,(H,19,23)
InChIKey HTMQMHDQFLWOEL-UHFFFAOYSA-N
Mol Weight 355.35 g/mol
Molecular Formula C18H17N3O5
Exact Mass 355.116821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CALLYHPdZZ
Name 1H-Pyrazole-1-acetic acid, 3-methyl-5-[[(2-oxo-2H-1-benzopyran-3-yl)carbonyl]amino]-, ethyl ester
Alternate Name(s) 2-[3-methyl-5-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]-1-pyrazolyl]acetic acid ethyl ester Ethyl 2-[3-methyl-5-[(2-oxochromene-3-carbonyl)amino]pyrazol-1-yl]acetate Ethyl 2-[3-methyl-5-[(2-oxidanylidenechromen-3-yl)carbonylamino]pyrazol-1-yl]ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N3O5
InChI InChI=1S/C18H17N3O5/c1-3-25-16(22)10-21-15(8-11(2)20-21)19-17(23)13-9-12-6-4-5-7-14(12)26-18(13)24/h4-9H,3,10H2,1-2H3,(H,19,23)
InChIKey HTMQMHDQFLWOEL-UHFFFAOYSA-N
Molecular Weight 355.350 g/mol
SMILES N(C(=O)C1=Cc2c(OC1=O)cccc2)c1[n](nc(c1)C)CC(OCC)=O
SPLASH splash10-00di-4942000000-600778e49c79c01b749b
Source of Spectrum IY-2-4711-4
Wiley ID 1655097