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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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