2-(2-methyl-4-nitro-1H-imidazol-3-ium-3-yl)ethyl N-(3,4-dichlorophenyl)carbamate

Systemtic Name: 2-(2-methyl-4-nitro-1H-imidazol-3-ium-3-yl)ethyl N-(3,4-dichlorophenyl)carbamate Openeye Name: 2-(2-methyl-4-nitro-1H-imidazol-3-ium-3-yl)ethyl N-(3,4-dichlorophenyl)carbamate CAS Name: N-(3,4-dichlorophenyl)carbamic acid 2-(2-methyl-4-nitro-1H-imidazol-3-ium-3-yl)ethyl ester IUPAC Name: 2-(2-methyl-4-nitro-1H-imidazol-3-ium-3-yl)ethyl N-(3,4-dichlorophenyl)carbamate Traditional Name: N-(3,4-dichlorophenyl)carbamic acid 2-(2-methyl-4-nitro-1H-imidazol-3-ium-3-yl)ethyl ester Formula: C13H13Cl2N4O4+ MolecularWeight: 360.17272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CN1)[N+](=O)[O-])CCOC(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC1=[N+](C(=CN1)[N+](=O)[O-])CCOC(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H12Cl2N4O4/c1-8-16-7-12(19(21)22)18(8)4-5-23-13(20)17-9-2-3-10(14)11(15)6-9/h2-3,6-7H,4-5H2,1H3,(H,17,20)/p+1