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

Systemtic Name: 4-ethanoyl-N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzenesulfonamide Openeye Name: 4-acetyl-N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzenesulfonamide CAS Name: 4-acetyl-N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzenesulfonamide Traditional Name: 4-acetyl-N-methyl-N-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]benzenesulfonamide Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C18H18N2O7S/c1-12(21)13-3-5-17(6-4-13)28(24,25)19(2)9-14-7-16(20(22)23)8-15-10-26-11-27-18(14)15/h3-8H,9-11H2,1-2H3