4-(1-imidazol-1-ylethyl)-N-methyl-2-nitro-aniline

Systemtic Name: 4-(1-imidazol-1-ylethyl)-N-methyl-2-nitro-aniline Openeye Name: 4-(1-imidazol-1-ylethyl)-N-methyl-2-nitro-aniline CAS Name: 4-[1-(1-imidazolyl)ethyl]-N-methyl-2-nitroaniline IUPAC Name: 4-(1-imidazol-1-ylethyl)-N-methyl-2-nitroaniline Traditional Name: [4-(1-imidazol-1-ylethyl)-2-nitro-phenyl]-methyl-amine Formula: C12H14N4O2 MolecularWeight: 246.26516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)NC)[N+](=O)[O-])N2C=CN=C2

Isomeric SMILES

CC(C1=CC(=C(C=C1)NC)[N+](=O)[O-])N2C=CN=C2

InChI

InChI=1S/C12H14N4O2/c1-9(15-6-5-14-8-15)10-3-4-11(13-2)12(7-10)16(17)18/h3-9,13H,1-2H3