4-(2-bromanyl-4-methyl-phenoxy)-7-nitro-2,1,3-benzoxadiazole

Systemtic Name: 4-(2-bromanyl-4-methyl-phenoxy)-7-nitro-2,1,3-benzoxadiazole Openeye Name: 4-(2-bromo-4-methyl-phenoxy)-7-nitro-2,1,3-benzoxadiazole CAS Name: 4-(2-bromo-4-methylphenoxy)-7-nitro-2,1,3-benzoxadiazole IUPAC Name: 4-(2-bromo-4-methylphenoxy)-7-nitro-2,1,3-benzoxadiazole Traditional Name: 4-(2-bromo-4-methyl-phenoxy)-7-nitro-benzofurazan Formula: C13H8BrN3O4 MolecularWeight: 350.12432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=CC=C(C3=NON=C23)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=CC=C(C3=NON=C23)[N+](=O)[O-])Br

InChI

InChI=1S/C13H8BrN3O4/c1-7-2-4-10(8(14)6-7)20-11-5-3-9(17(18)19)12-13(11)16-21-15-12/h2-6H,1H3