O3-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(7-bromo-2-oxo-chromen-4-yl)methyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(7-bromo-2-oxo-1-benzopyran-4-yl)methyl] ester O1-ethyl ester IUPAC Name: 3-O-[(7-bromo-2-oxochromen-4-yl)methyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(7-bromo-2-keto-chromen-4-yl)methyl] ester O1-ethyl ester Formula: C20H14BrNO8 MolecularWeight: 476.23106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C20H14BrNO8/c1-2-28-19(24)11-5-12(7-15(6-11)22(26)27)20(25)29-10-13-8-18(23)30-17-9-14(21)3-4-16(13)17/h3-9H,2,10H2,1H3