dimethyl 6-bromanyl-4,10-bis(oxidanylidene)-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylate

Systemtic Name: dimethyl 6-bromanyl-4,10-bis(oxidanylidene)-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylate Openeye Name: dimethyl 6-bromo-4,10-dioxo-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylate CAS Name: 6-bromo-4,10-dioxo-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6-bromo-4,10-dioxo-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylate Traditional Name: 6-bromo-4,10-diketo-1,7-dihydro-1,7-phenanthroline-2,8-dicarboxylic acid dimethyl ester Formula: C16H11BrN2O6 MolecularWeight: 407.17234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)C2=CC(=C3C(=C2N1)C(=O)C=C(N3)C(=O)OC)Br

Isomeric SMILES

COC(=O)C1=CC(=O)C2=CC(=C3C(=C2N1)C(=O)C=C(N3)C(=O)OC)Br

InChI

InChI=1S/C16H11BrN2O6/c1-24-15(22)8-4-10(20)6-3-7(17)14-12(13(6)18-8)11(21)5-9(19-14)16(23)25-2/h3-5H,1-2H3,(H,18,20)(H,19,21)