4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(2-methyl-4-nitro-phenyl)benzenesulfonamide

Systemtic Name: 4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(2-methyl-4-nitro-phenyl)benzenesulfonamide Openeye Name: 4-[(1,3-dioxoisoindolin-2-yl)methyl]-N-(2-methyl-4-nitro-phenyl)benzenesulfonamide CAS Name: 4-[(1,3-dioxo-2-isoindolyl)methyl]-N-(2-methyl-4-nitrophenyl)benzenesulfonamide IUPAC Name: 4-[(1,3-dioxoisoindol-2-yl)methyl]-N-(2-methyl-4-nitrophenyl)benzenesulfonamide Traditional Name: N-(2-methyl-4-nitro-phenyl)-4-(phthalimidomethyl)benzenesulfonamide Formula: C22H17N3O6S MolecularWeight: 451.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H17N3O6S/c1-14-12-16(25(28)29)8-11-20(14)23-32(30,31)17-9-6-15(7-10-17)13-24-21(26)18-4-2-3-5-19(18)22(24)27/h2-12,23H,13H2,1H3