1-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole

Systemtic Name: 1-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole Openeye Name: 1-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole CAS Name: 1-[6-(4-chloro-3-methylphenoxy)-5-nitro-4-pyrimidinyl]benzimidazole IUPAC Name: 1-[6-(4-chloro-3-methylphenoxy)-5-nitropyrimidin-4-yl]benzimidazole Traditional Name: 1-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole Formula: C18H12ClN5O3 MolecularWeight: 381.77258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43)Cl

InChI

InChI=1S/C18H12ClN5O3/c1-11-8-12(6-7-13(11)19)27-18-16(24(25)26)17(20-9-21-18)23-10-22-14-4-2-3-5-15(14)23/h2-10H,1H3