1-[(2-methoxy-5-methyl-phenyl)methyl]-4-nitro-imidazole

Systemtic Name: 1-[(2-methoxy-5-methyl-phenyl)methyl]-4-nitro-imidazole Openeye Name: 1-[(2-methoxy-5-methyl-phenyl)methyl]-4-nitro-imidazole CAS Name: 1-[(2-methoxy-5-methylphenyl)methyl]-4-nitroimidazole IUPAC Name: 1-[(2-methoxy-5-methylphenyl)methyl]-4-nitroimidazole Traditional Name: 1-(2-methoxy-5-methyl-benzyl)-4-nitro-imidazole Formula: C12H13N3O3 MolecularWeight: 247.24992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O3/c1-9-3-4-11(18-2)10(5-9)6-14-7-12(13-8-14)15(16)17/h3-5,7-8H,6H2,1-2H3