1-methyl-2-[(3-methyl-4-nitro-phenoxy)methyl]-5-nitro-imidazole

Systemtic Name: 1-methyl-2-[(3-methyl-4-nitro-phenoxy)methyl]-5-nitro-imidazole Openeye Name: 1-methyl-2-[(3-methyl-4-nitro-phenoxy)methyl]-5-nitro-imidazole CAS Name: 1-methyl-2-[(3-methyl-4-nitrophenoxy)methyl]-5-nitroimidazole IUPAC Name: 1-methyl-2-[(3-methyl-4-nitrophenoxy)methyl]-5-nitroimidazole Traditional Name: 1-methyl-2-[(3-methyl-4-nitro-phenoxy)methyl]-5-nitro-imidazole Formula: C12H12N4O5 MolecularWeight: 292.24748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC=C(N2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC=C(N2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O5/c1-8-5-9(3-4-10(8)15(17)18)21-7-11-13-6-12(14(11)2)16(19)20/h3-6H,7H2,1-2H3