N-methyl-N-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]benzenesulfonamide

Systemtic Name: N-methyl-N-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]benzenesulfonamide Openeye Name: N-methyl-N-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]benzenesulfonamide CAS Name: N-methyl-N-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]benzenesulfonamide IUPAC Name: N-methyl-N-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]benzenesulfonamide Traditional Name: N-methyl-N-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]benzenesulfonamide Formula: C22H20N2O7S MolecularWeight: 456.4684

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N2O7S/c1-23(32(27,28)21-5-3-2-4-6-21)18-7-9-20(10-8-18)30-14-17-12-19(24(25)26)11-16-13-29-15-31-22(16)17/h2-12H,13-15H2,1H3