ethyl 4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyloxymethyl]-3-bromanyl-benzoate

Systemtic Name: ethyl 4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyloxymethyl]-3-bromanyl-benzoate Openeye Name: ethyl 3-bromo-4-[[2-(1,3-dioxoisoindolin-2-yl)acetyl]oxymethyl]benzoate CAS Name: 3-bromo-4-[[2-(1,3-dioxo-2-isoindolyl)-1-oxoethoxy]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[[2-(1,3-dioxoisoindol-2-yl)acetyl]oxymethyl]benzoate Traditional Name: 3-bromo-4-[(2-phthalimidoacetyl)oxymethyl]benzoic acid ethyl ester Formula: C20H16BrNO6 MolecularWeight: 446.24814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)COC(=O)CN2C(=O)C3=CC=CC=C3C2=O)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)COC(=O)CN2C(=O)C3=CC=CC=C3C2=O)Br

InChI

InChI=1S/C20H16BrNO6/c1-2-27-20(26)12-7-8-13(16(21)9-12)11-28-17(23)10-22-18(24)14-5-3-4-6-15(14)19(22)25/h3-9H,2,10-11H2,1H3