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

Systemtic Name: O3-[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] 1-O-ethyl 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-ethyl ester Formula: C19H16BrNO8 MolecularWeight: 466.23624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)C2=CC(=C(C=C2)OC)Br)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)C2=CC(=C(C=C2)OC)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H16BrNO8/c1-3-28-18(23)12-6-13(8-14(7-12)21(25)26)19(24)29-10-16(22)11-4-5-17(27-2)15(20)9-11/h4-9H,3,10H2,1-2H3