4-[(2-imidazol-1-ylphenyl)methyl]-N-methyl-2-nitro-aniline

Systemtic Name: 4-[(2-imidazol-1-ylphenyl)methyl]-N-methyl-2-nitro-aniline Openeye Name: 4-[(2-imidazol-1-ylphenyl)methyl]-N-methyl-2-nitro-aniline CAS Name: 4-[[2-(1-imidazolyl)phenyl]methyl]-N-methyl-2-nitroaniline IUPAC Name: 4-[(2-imidazol-1-ylphenyl)methyl]-N-methyl-2-nitroaniline Traditional Name: [4-(2-imidazol-1-ylbenzyl)-2-nitro-phenyl]-methyl-amine Formula: C17H16N4O2 MolecularWeight: 308.33454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)CC2=CC=CC=C2N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)CC2=CC=CC=C2N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O2/c1-18-15-7-6-13(11-17(15)21(22)23)10-14-4-2-3-5-16(14)20-9-8-19-12-20/h2-9,11-12,18H,10H2,1H3