4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]morpholin-4-ium

Systemtic Name: 4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]morpholin-4-ium Openeye Name: 4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]morpholin-4-ium CAS Name: 4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]morpholin-4-ium IUPAC Name: 4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]morpholin-4-ium Traditional Name: 4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]morpholin-4-ium Formula: C13H17N2O5+ MolecularWeight: 281.28448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

C1COCC[NH+]1CC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C13H16N2O5/c16-15(17)12-5-10(7-14-1-3-18-4-2-14)13-11(6-12)8-19-9-20-13/h5-6H,1-4,7-9H2/p+1