4-[(4-methyl-3-nitro-phenoxy)methyl]-2,1,3-benzothiadiazole

Systemtic Name: 4-[(4-methyl-3-nitro-phenoxy)methyl]-2,1,3-benzothiadiazole Openeye Name: 4-[(4-methyl-3-nitro-phenoxy)methyl]-2,1,3-benzothiadiazole CAS Name: 4-[(4-methyl-3-nitrophenoxy)methyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[(4-methyl-3-nitrophenoxy)methyl]-2,1,3-benzothiadiazole Traditional Name: 4-[(4-methyl-3-nitro-phenoxy)methyl]piazthiole Formula: C14H11N3O3S MolecularWeight: 301.32044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=CC=CC3=NSN=C32)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=CC=CC3=NSN=C32)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O3S/c1-9-5-6-11(7-13(9)17(18)19)20-8-10-3-2-4-12-14(10)16-21-15-12/h2-7H,8H2,1H3