N-[[4-(methoxymethyl)phenyl]methyl]-3-methyl-5-nitro-imidazol-4-amine

Systemtic Name: N-[[4-(methoxymethyl)phenyl]methyl]-3-methyl-5-nitro-imidazol-4-amine Openeye Name: N-[[4-(methoxymethyl)phenyl]methyl]-3-methyl-5-nitro-imidazol-4-amine CAS Name: N-[[4-(methoxymethyl)phenyl]methyl]-3-methyl-5-nitro-4-imidazolamine IUPAC Name: N-[[4-(methoxymethyl)phenyl]methyl]-3-methyl-5-nitroimidazol-4-amine Traditional Name: [4-(methoxymethyl)benzyl]-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C13H16N4O3 MolecularWeight: 276.29114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCC2=CC=C(C=C2)COC)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCC2=CC=C(C=C2)COC)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O3/c1-16-9-15-13(17(18)19)12(16)14-7-10-3-5-11(6-4-10)8-20-2/h3-6,9,14H,7-8H2,1-2H3