(6-bromanyl-4-nitro-2-oxidanylidene-1,3-benzoxathiol-5-yl) phenyl carbonate

Systemtic Name: (6-bromanyl-4-nitro-2-oxidanylidene-1,3-benzoxathiol-5-yl) phenyl carbonate Openeye Name: (6-bromo-4-nitro-2-oxo-1,3-benzoxathiol-5-yl) phenyl carbonate CAS Name: carbonic acid (6-bromo-4-nitro-2-oxo-1,3-benzoxathiol-5-yl) phenyl ester IUPAC Name: (6-bromo-4-nitro-2-oxo-1,3-benzoxathiol-5-yl) phenyl carbonate Traditional Name: carbonic acid (6-bromo-2-keto-4-nitro-1,3-benzoxathiol-5-yl) phenyl ester Formula: C14H6BrNO7S MolecularWeight: 412.16894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)OC2=C(C=C3C(=C2[N+](=O)[O-])SC(=O)O3)Br

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)OC2=C(C=C3C(=C2[N+](=O)[O-])SC(=O)O3)Br

InChI

InChI=1S/C14H6BrNO7S/c15-8-6-9-12(24-14(18)22-9)10(16(19)20)11(8)23-13(17)21-7-4-2-1-3-5-7/h1-6H