N,N-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]benzotriazole-5-sulfonamide

Systemtic Name: N,N-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]benzotriazole-5-sulfonamide Openeye Name: N,N-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]benzotriazole-5-sulfonamide CAS Name: N,N-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-5-benzotriazolesulfonamide IUPAC Name: N,N-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]benzotriazole-5-sulfonamide Traditional Name: N,N-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]benzotriazole-5-sulfonamide Formula: C17H17N5O7S MolecularWeight: 435.41118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C17H17N5O7S/c1-20(2)30(25,26)14-3-4-15-16(7-14)21(19-18-15)29-9-12-6-13(22(23)24)5-11-8-27-10-28-17(11)12/h3-7H,8-10H2,1-2H3