O3-[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(3-bromo-4-methoxy-phenyl)-2-keto-ethyl] ester O1-methyl ester Formula: C18H14BrNO8 MolecularWeight: 452.20966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-])Br

InChI

InChI=1S/C18H14BrNO8/c1-26-16-4-3-10(8-14(16)19)15(21)9-28-18(23)12-5-11(17(22)27-2)6-13(7-12)20(24)25/h3-8H,9H2,1-2H3