4-[2-(6-methoxy-1-oxidanyl-3-oxidanylidene-1-phenyl-isoindol-2-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-[2-(6-methoxy-1-oxidanyl-3-oxidanylidene-1-phenyl-isoindol-2-yl)ethyl]benzenesulfonamide Openeye Name: 4-[2-(1-hydroxy-6-methoxy-3-oxo-1-phenyl-isoindolin-2-yl)ethyl]benzenesulfonamide CAS Name: 4-[2-(1-hydroxy-6-methoxy-3-oxo-1-phenyl-2-isoindolyl)ethyl]benzenesulfonamide IUPAC Name: 4-[2-(1-hydroxy-6-methoxy-3-oxo-1-phenylisoindol-2-yl)ethyl]benzenesulfonamide Traditional Name: 4-[2-(1-hydroxy-3-keto-6-methoxy-1-phenyl-isoindolin-2-yl)ethyl]benzenesulfonamide Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)N(C2(C3=CC=CC=C3)O)CCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)N(C2(C3=CC=CC=C3)O)CCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C23H22N2O5S/c1-30-18-9-12-20-21(15-18)23(27,17-5-3-2-4-6-17)25(22(20)26)14-13-16-7-10-19(11-8-16)31(24,28)29/h2-12,15,27H,13-14H2,1H3,(H2,24,28,29)