[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 6-(1,3-dioxoisoindolin-2-yl)hexanoate CAS Name: 6-(1,3-dioxo-2-isoindolyl)hexanoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 6-(1,3-dioxoisoindol-2-yl)hexanoate Traditional Name: 6-phthalimidohexanoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C22H20BrNO5 MolecularWeight: 458.3019

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H20BrNO5/c23-16-11-9-15(10-12-16)19(25)14-29-20(26)8-2-1-5-13-24-21(27)17-6-3-4-7-18(17)22(24)28/h3-4,6-7,9-12H,1-2,5,8,13-14H2