4-[2-[5-(1-adamantyl)-1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[5-(1-adamantyl)-1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]benzenesulfonamide Openeye Name: 4-[2-[5-(1-adamantyl)-1,3-dioxo-isoindolin-2-yl]ethyl]benzenesulfonamide CAS Name: 4-[2-[5-(1-adamantyl)-1,3-dioxo-2-isoindolyl]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[5-(1-adamantyl)-1,3-dioxoisoindol-2-yl]ethyl]benzenesulfonamide Traditional Name: 4-[2-[5-(1-adamantyl)-1,3-diketo-isoindolin-2-yl]ethyl]benzenesulfonamide Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)C(=O)N(C5=O)CCC6=CC=C(C=C6)S(=O)(=O)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)C(=O)N(C5=O)CCC6=CC=C(C=C6)S(=O)(=O)N

InChI

InChI=1S/C26H28N2O4S/c27-33(31,32)21-4-1-16(2-5-21)7-8-28-24(29)22-6-3-20(12-23(22)25(28)30)26-13-17-9-18(14-26)11-19(10-17)15-26/h1-6,12,17-19H,7-11,13-15H2,(H2,27,31,32)