8-[2-(diisobutylamino)-5-nitro-phenyl]-3,5-dimethyl-7-oxa-3,5-diazabicyclo[4.2.0]oct-1(6)-ene-2,4-dione

SpectraBase Compound ID	2s6HiFX7FZZ
InChI	InChI=1S/C21H28N4O5/c1-12(2)10-24(11-13(3)4)16-8-7-14(25(28)29)9-15(16)18-17-19(26)22(5)21(27)23(6)20(17)30-18/h7-9,12-13,18H,10-11H2,1-6H3
InChIKey	OVBKPNSVSMINOJ-UHFFFAOYSA-N Google Search
Mol Weight	416.48 g/mol
Molecular Formula	C21H28N4O5
Exact Mass	416.20597 g/mol

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SpectraBase Spectrum ID	J6ZqQYR6wf3
Name	8-[2-(diisobutylamino)-5-nitro-phenyl]-3,5-dimethyl-7-oxa-3,5-diazabicyclo[4.2.0]oct-1(6)-ene-2,4-dione
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H28N4O5
InChI	InChI=1S/C21H28N4O5/c1-12(2)10-24(11-13(3)4)16-8-7-14(25(28)29)9-15(16)18-17-19(26)22(5)21(27)23(6)20(17)30-18/h7-9,12-13,18H,10-11H2,1-6H3
InChIKey	OVBKPNSVSMINOJ-UHFFFAOYSA-N
Molecular Weight	416.478 g/mol
SMILES	C12=C(N(C)C(N(C2=O)C)=O)OC1c1c(N(CC(C)C)CC(C)C)ccc(N(=O)=O)c1
SPLASH	splash10-0abc-7923000000-06c37ca0c61fd284b5de
Synonyms	8-[2-(diisobutylamino)-5-nitro-phenyl]-3,5-dimethyl-7-oxa-3,5-diazabicyclo[4.2.0]oct-1(6)-ene-2,4-quinone 8-[2-[bis(2-methylpropyl)amino]-5-nitro-phenyl]-3,5-dimethyl-7-oxa-3,5-diazabicyclo[4.2.0]oct-1(6)-ene-2,4-dione
Wiley ID	1453566