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

Systemtic Name: N-[4-[3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propanoylamino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[3-(5-bromo-1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[3-(5-bromo-1,3-dioxoisoindol-2-yl)propanoylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[3-(5-bromo-1,3-diketo-isoindolin-2-yl)propanoylamino]phenyl]-2-furamide Formula: C22H16BrN3O5 MolecularWeight: 482.28354

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C22H16BrN3O5/c23-13-3-8-16-17(12-13)22(30)26(21(16)29)10-9-19(27)24-14-4-6-15(7-5-14)25-20(28)18-2-1-11-31-18/h1-8,11-12H,9-10H2,(H,24,27)(H,25,28)