N-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenoxy-pentyl]-4-bromanyl-benzenesulfonamide

Systemtic Name: N-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenoxy-pentyl]-4-bromanyl-benzenesulfonamide Openeye Name: 4-bromo-N-[5-(1,3-dioxoisoindolin-2-yl)-3-phenoxy-pentyl]benzenesulfonamide CAS Name: 4-bromo-N-[5-(1,3-dioxo-2-isoindolyl)-3-phenoxypentyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[5-(1,3-dioxoisoindol-2-yl)-3-phenoxypentyl]benzenesulfonamide Traditional Name: 4-bromo-N-(3-phenoxy-5-phthalimido-pentyl)benzenesulfonamide Formula: C25H23BrN2O5S MolecularWeight: 543.42952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CCNS(=O)(=O)C2=CC=C(C=C2)Br)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)OC(CCNS(=O)(=O)C2=CC=C(C=C2)Br)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H23BrN2O5S/c26-18-10-12-21(13-11-18)34(31,32)27-16-14-20(33-19-6-2-1-3-7-19)15-17-28-24(29)22-8-4-5-9-23(22)25(28)30/h1-13,20,27H,14-17H2