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Amb1011999

Duplicate ID
Molecule Name isopentyl 2-{4-nitrophenyl}-1,3-dioxo-5-isoindolinecarboxylate
3-methylbutyl 2-(4-nitrophenyl)-1,3-dioxoisoindoline-5-carboxylate
SmilesCC(CCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])C
Cas Number
InchiKeyUETDZKGQKOQSCG-UHFFFAOYSA-N
InChi InChI=1S/C20H18N2O6/c1-12(2)9-10-28-20(25)13-3-8-16-17(11-13)19(24)21(18(16)23)14-4-6-15(7-5-14)22(26)27/h3-8,11-12H,9-10H2,1-2H3
Formula C20H18N2O6
Molecular weight 382.367
Rings 3
logP 4.1865
PSA 109.5
MR 106.289
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