6-(3,5-dimethylphenoxy)-5-nitro-N-phenyl-pyrimidin-4-amine

Systemtic Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-phenyl-pyrimidin-4-amine Openeye Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-phenyl-pyrimidin-4-amine CAS Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-phenyl-4-pyrimidinamine IUPAC Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-phenylpyrimidin-4-amine Traditional Name: [6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]-phenyl-amine Formula: C18H16N4O3 MolecularWeight: 336.34464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3)C

InChI

InChI=1S/C18H16N4O3/c1-12-8-13(2)10-15(9-12)25-18-16(22(23)24)17(19-11-20-18)21-14-6-4-3-5-7-14/h3-11H,1-2H3,(H,19,20,21)