N-[4-[4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[4-(5-bromo-1,3-dioxo-isoindolin-2-yl)butanoylamino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[4-(5-bromo-1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[4-(5-bromo-1,3-dioxoisoindol-2-yl)butanoylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[4-(5-bromo-1,3-diketo-isoindolin-2-yl)butanoylamino]phenyl]-2-furamide Formula: C23H18BrN3O5 MolecularWeight: 496.31012

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C23H18BrN3O5/c24-14-5-10-17-18(13-14)23(31)27(22(17)30)11-1-4-20(28)25-15-6-8-16(9-7-15)26-21(29)19-3-2-12-32-19/h2-3,5-10,12-13H,1,4,11H2,(H,25,28)(H,26,29)