7-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3,4-bis(oxidanyl)oxolan-2-yl]-3-[(2-nitrophenyl)methyl]imidazo[4,5-d][1,2,3]triazin-4-one

Systemtic Name: 7-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3,4-bis(oxidanyl)oxolan-2-yl]-3-[(2-nitrophenyl)methyl]imidazo[4,5-d][1,2,3]triazin-4-one Openeye Name: 7-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]-3-[(2-nitrophenyl)methyl]imidazo[4,5-d]triazin-4-one CAS Name: 7-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3,4-dihydroxy-2-oxolanyl]-3-[(2-nitrophenyl)methyl]-4-imidazo[4,5-d]triazinone IUPAC Name: 7-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3,4-dihydroxyoxolan-2-yl]-3-[(2-nitrophenyl)methyl]imidazo[4,5-d]triazin-4-one Traditional Name: 7-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]-3-(2-nitrobenzyl)imidazo[4,5-d]triazin-4-one Formula: C37H34N6O9 MolecularWeight: 706.70066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(C(C(O4)N5C=NC6=C5N=NN(C6=O)CC7=CC=CC=C7[N+](=O)[O-])O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(C(C(O4)N5C=NC6=C5N=NN(C6=O)CC7=CC=CC=C7[N+](=O)[O-])O)O

InChI

InChI=1S/C37H34N6O9/c1-49-27-16-12-25(13-17-27)37(24-9-4-3-5-10-24,26-14-18-28(50-2)19-15-26)51-21-30-32(44)33(45)36(52-30)41-22-38-31-34(41)39-40-42(35(31)46)20-23-8-6-7-11-29(23)43(47)48/h3-19,22,30,32-33,36,44-45H,20-21H2,1-2H3