1-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole

Systemtic Name: 1-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole Openeye Name: 1-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole CAS Name: 1-[6-(3,5-dimethylphenoxy)-5-nitro-4-pyrimidinyl]benzimidazole IUPAC Name: 1-[6-(3,5-dimethylphenoxy)-5-nitropyrimidin-4-yl]benzimidazole Traditional Name: 1-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]benzimidazole Formula: C19H15N5O3 MolecularWeight: 361.3541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15N5O3/c1-12-7-13(2)9-14(8-12)27-19-17(24(25)26)18(20-10-21-19)23-11-22-15-5-3-4-6-16(15)23/h3-11H,1-2H3