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Nombre: 2-[2-methoxy-5-nitro-4-(4,4-dimethyl-7-nitro-2H,4H-isoquinolin-1,3-dione-2-yl)-phenyl]-5-methoxy-imidazo[4,5-b]pyridine

IUPAC: 2-[5-methoxy-4-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-nitrophenyl]-4,4-dimethyl-7-nitroisoquinoline-1,3-dione

SMILES: COc1ccc2[nH]c(-c3cc([N+](=O)[O-])c(N4C(=O)c5cc([N+](=O)[O-])ccc5C(C)(C)C4=O)cc3OC)nc2n1

Canonical SMILES: CC1(C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N(C1=O)C3=C(C=C(C(=C3)OC)C4=NC5=C(N4)C=CC(=N5)OC)[N+](=O)[O-])C

Fórmula molecular: C25H20N6O8

Masa molecular: 532.50

InChIKey: PDKJCGRXUUYBNA-UHFFFAOYSA-N

InChI: InChI=1S/C25H20N6O8/c1-25(2)15-6-5-12(30(34)35)9-13(15)23(32)29(24(25)33)17-11-19(38-3)14(10-18(17)31(36)37)21-26-16-7-8-20(39-4)27-22(16)28-21/h5-11H,1-4H3,(H,26,27,28)

PubChem CID: 20153278 →

Sinónimos

SCHEMBL10689845PDKJCGRXUUYBNA-UHFFFAOYSA-N2-[2-methoxy-5-nitro-4-(4,4-dimethyl-7-nitro-2H,4H-isoquinolin-1,3-dione-2-yl)-phenyl]-5-methoxy-imidazo[4,5-b]pyridine

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