3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl 5-bromanyl-1-benzofuran-2-carboxylate

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl 5-bromanyl-1-benzofuran-2-carboxylate Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propyl 5-bromobenzofuran-2-carboxylate CAS Name: 5-bromo-2-benzofurancarboxylic acid 3-(5-bromo-1,3-dioxo-2-isoindolyl)propyl ester IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)propyl 5-bromo-1-benzofuran-2-carboxylate Traditional Name: 5-bromocoumarilic acid 3-(5-bromo-1,3-diketo-isoindolin-2-yl)propyl ester Formula: C20H13Br2NO5 MolecularWeight: 507.12892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=O)N(C2=O)CCCOC(=O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=O)N(C2=O)CCCOC(=O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C20H13Br2NO5/c21-12-3-5-16-11(8-12)9-17(28-16)20(26)27-7-1-6-23-18(24)14-4-2-13(22)10-15(14)19(23)25/h2-5,8-10H,1,6-7H2