5-methoxy-2-(4-nitrophenoxy)-2-propan-2-yl-1,2,4,6-thiatriazin-2-ium 1,1-dioxide

Systemtic Name: 5-methoxy-2-(4-nitrophenoxy)-2-propan-2-yl-1,2,4,6-thiatriazin-2-ium 1,1-dioxide Openeye Name: 2-isopropyl-5-methoxy-2-(4-nitrophenoxy)-1,2,4,6-thiatriazin-2-ium 1,1-dioxide CAS Name: 5-methoxy-2-(4-nitrophenoxy)-2-propan-2-yl-1,2,4,6-thiatriazin-2-ium 1,1-dioxide IUPAC Name: 5-methoxy-2-(4-nitrophenoxy)-2-propan-2-yl-1,2,4,6-thiatriazin-2-ium 1,1-dioxide Traditional Name: 2-isopropyl-5-methoxy-2-(4-nitrophenoxy)-1,2,4,6-thiatriazin-2-ium 1,1-dioxide Formula: C12H15N4O6S+ MolecularWeight: 343.3357

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(C=NC(=NS1(=O)=O)OC)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)[N+]1(C=NC(=NS1(=O)=O)OC)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N4O6S/c1-9(2)16(8-13-12(21-3)14-23(16,19)20)22-11-6-4-10(5-7-11)15(17)18/h4-9H,1-3H3/q+1