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3-{1,3-dioxo-5-[(3-pyridinylamino)carbonyl]-1,3-dihydro-2H-isoindol-2-yl}phenyl acetate
SpectraBase Compound ID 6kklQRVQ9MU
InChI InChI=1S/C22H15N3O5/c1-13(26)30-17-6-2-5-16(11-17)25-21(28)18-8-7-14(10-19(18)22(25)29)20(27)24-15-4-3-9-23-12-15/h2-12H,1H3,(H,24,27)
InChIKey PTIXKNRWSPTHGF-UHFFFAOYSA-N
Mol Weight 401.38 g/mol
Molecular Formula C22H15N3O5
Exact Mass 401.101171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xG0vPrwye0
Name 3-{1,3-dioxo-5-[(3-pyridinylamino)carbonyl]-1,3-dihydro-2H-isoindol-2-yl}phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15N3O5
InChI InChI=1S/C22H15N3O5/c1-13(26)30-17-6-2-5-16(11-17)25-21(28)18-8-7-14(10-19(18)22(25)29)20(27)24-15-4-3-9-23-12-15/h2-12H,1H3,(H,24,27)
InChIKey PTIXKNRWSPTHGF-UHFFFAOYSA-N
Molecular Weight 401.378 g/mol
SMILES N(C(c1cc2C(N(C(c2cc1)=O)c1cc(OC(=O)C)ccc1)=O)=O)c1cnccc1
SPLASH splash10-0ldl-9353000000-a2ffa67de86177c97ef3
Synonyms Acetic acid 3-[1,3-dioxo-5-(pyridin-3-ylcarbamoyl)-1,3-dihydro-isoindol-2-yl]-phenyl ester Acetic acid[3-[1,3-diketo-5-(3-pyridylcarbamoyl)isoindolin-2-yl]phenyl]ester Acetic acid[3-[1,3-dioxo-5-[oxo-(3-pyridinylamino)methyl]-2-isoindolyl]phenyl]ester [3-[1,3-bis(oxidanylidene)-5-(pyridin-3-ylcarbamoyl)isoindol-2-yl]phenyl]ethanoate [3-[1,3-dioxo-5-(3-pyridylcarbamoyl)isoindolin-2-yl]phenyl]acetate [3-[1,3-dioxo-5-(pyridin-3-ylcarbamoyl)isoindol-2-yl]phenyl]acetate Acetic acid [3-[1,3-dioxo-5-[oxo-(3-pyridinylamino)methyl]-2-isoindolyl]phenyl] ester [3-[1,3-dioxo-5-(pyridin-3-ylcarbamoyl)isoindol-2-yl]phenyl] acetate [3-[1,3-dioxo-5-(3-pyridylcarbamoyl)isoindolin-2-yl]phenyl] acetate [3-[1,3-bis(oxidanylidene)-5-(pyridin-3-ylcarbamoyl)isoindol-2-yl]phenyl] ethanoate
Wiley ID 1445314