6-(4-methylphenoxy)-5-nitro-N-pyridin-4-yl-pyrimidin-4-amine

Systemtic Name: 6-(4-methylphenoxy)-5-nitro-N-pyridin-4-yl-pyrimidin-4-amine Openeye Name: 6-(4-methylphenoxy)-5-nitro-N-(4-pyridyl)pyrimidin-4-amine CAS Name: 6-(4-methylphenoxy)-5-nitro-N-pyridin-4-yl-4-pyrimidinamine IUPAC Name: 6-(4-methylphenoxy)-5-nitro-N-pyridin-4-ylpyrimidin-4-amine Traditional Name: [6-(4-methylphenoxy)-5-nitro-pyrimidin-4-yl]-(4-pyridyl)amine Formula: C16H13N5O3 MolecularWeight: 323.30612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N5O3/c1-11-2-4-13(5-3-11)24-16-14(21(22)23)15(18-10-19-16)20-12-6-8-17-9-7-12/h2-10H,1H3,(H,17,18,19,20)