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(2E)-2(1-Acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-N-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(4-methylphenyl)-4-oxobutanamide

View entire compound with spectra: 1 MS (GC)

(2E)-2(1-Acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-N-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(4-methylphenyl)-4-oxobutanamide
SpectraBase Compound ID 3HE5Ia110Vq
InChI InChI=1S/C29H21N3O6/c1-16-11-13-18(14-12-16)24(34)15-22(25-21-9-5-6-10-23(21)31(17(2)33)29(25)38)26(35)30-32-27(36)19-7-3-4-8-20(19)28(32)37/h3-14H,15H2,1-2H3,(H,30,35)/b25-22+
InChIKey LTKMHBHKMUTVHJ-YYDJUVGSSA-N
Mol Weight 507.5 g/mol
Molecular Formula C29H21N3O6
Exact Mass 507.143035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBRadvvhsoc
Name (2E)-2(1-Acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-N-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(4-methylphenyl)-4-oxobutanamide
Alternate Name(s) (E)-2-(1-acetyl-2-oxoindolin-3-ylidene)-N-(1,3-dioxoisoindolin-2-yl)-4-oxo-4-(p-tolyl)butanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H21N3O6
InChI InChI=1S/C29H21N3O6/c1-16-11-13-18(14-12-16)24(34)15-22(25-21-9-5-6-10-23(21)31(17(2)33)29(25)38)26(35)30-32-27(36)19-7-3-4-8-20(19)28(32)37/h3-14H,15H2,1-2H3,(H,30,35)/b25-22+
InChIKey LTKMHBHKMUTVHJ-YYDJUVGSSA-N
Literature Reference DOI 10.1002/hc.10175
Molecular Weight 507.502 g/mol
SMILES N(C(\C(=C\1C(N(c2ccccc12)C(C)=O)=O)CC(c1ccc(cc1)C)=O)=O)N1C(c2c(C1=O)cccc2)=O
SPLASH splash10-014i-0901000000-61f7f6daf21d235d62dd
Source of Spectrum HAC-14-440-6b
Wiley ID 1775942