6-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-N-propyl-pyrimidin-4-amine

Systemtic Name: 6-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-N-propyl-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-N-propyl-pyrimidin-4-amine CAS Name: 6-(4-chloro-3,5-dimethylphenoxy)-5-nitro-N-propyl-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3,5-dimethylphenoxy)-5-nitro-N-propylpyrimidin-4-amine Traditional Name: [6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]-propyl-amine Formula: C15H17ClN4O3 MolecularWeight: 336.77348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=NC=N1)OC2=CC(=C(C(=C2)C)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCCNC1=C(C(=NC=N1)OC2=CC(=C(C(=C2)C)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C15H17ClN4O3/c1-4-5-17-14-13(20(21)22)15(19-8-18-14)23-11-6-9(2)12(16)10(3)7-11/h6-8H,4-5H2,1-3H3,(H,17,18,19)