2-butyl-5-chloranyl-4-(methoxymethyl)-1-[[4-(2-nitrophenyl)phenyl]methyl]imidazole

Systemtic Name: 2-butyl-5-chloranyl-4-(methoxymethyl)-1-[[4-(2-nitrophenyl)phenyl]methyl]imidazole Openeye Name: 2-butyl-5-chloro-4-(methoxymethyl)-1-[[4-(2-nitrophenyl)phenyl]methyl]imidazole CAS Name: 2-butyl-5-chloro-4-(methoxymethyl)-1-[[4-(2-nitrophenyl)phenyl]methyl]imidazole IUPAC Name: 2-butyl-5-chloro-4-(methoxymethyl)-1-[[4-(2-nitrophenyl)phenyl]methyl]imidazole Traditional Name: 2-butyl-5-chloro-4-(methoxymethyl)-1-[4-(2-nitrophenyl)benzyl]imidazole Formula: C22H24ClN3O3 MolecularWeight: 413.89726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3[N+](=O)[O-])Cl)COC

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3[N+](=O)[O-])Cl)COC

InChI

InChI=1S/C22H24ClN3O3/c1-3-4-9-21-24-19(15-29-2)22(23)25(21)14-16-10-12-17(13-11-16)18-7-5-6-8-20(18)26(27)28/h5-8,10-13H,3-4,9,14-15H2,1-2H3