2-[(4-methyl-3-nitro-phenyl)sulfonyl-nitro-amino]ethyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate

Systemtic Name: 2-[(4-methyl-3-nitro-phenyl)sulfonyl-nitro-amino]ethyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate Openeye Name: 2-[(4-methyl-3-nitro-phenyl)sulfonyl-nitro-amino]ethyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate CAS Name: N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamic acid 2-[(4-methyl-3-nitrophenyl)sulfonyl-nitroamino]ethyl ester IUPAC Name: 2-[(4-methyl-3-nitrophenyl)sulfonyl-nitroamino]ethyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate Traditional Name: N-(4-methylfurazan-3-yl)carbamic acid 2-[(4-methyl-3-nitro-phenyl)sulfonyl-nitro-amino]ethyl ester Formula: C13H14N6O9S MolecularWeight: 430.35006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CCOC(=O)NC2=NON=C2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CCOC(=O)NC2=NON=C2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O9S/c1-8-3-4-10(7-11(8)18(21)22)29(25,26)17(19(23)24)5-6-27-13(20)14-12-9(2)15-28-16-12/h3-4,7H,5-6H2,1-2H3,(H,14,16,20)