N4-[4-(4-chloranylphenoxy)phenyl]-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[4-(4-chloranylphenoxy)phenyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[4-(4-chlorophenoxy)phenyl]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[4-(4-chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[4-(4-chlorophenoxy)phenyl]-5-nitropyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[4-(4-chlorophenoxy)phenyl]amine Formula: C16H12ClN5O3 MolecularWeight: 357.75118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN5O3/c17-10-1-5-12(6-2-10)25-13-7-3-11(4-8-13)21-16-14(22(23)24)15(18)19-9-20-16/h1-9H,(H3,18,19,20,21)