N-[4-chloranyl-3-(trifluoromethyl)phenyl]-6-naphthalen-1-yloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-6-naphthalen-1-yloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-6-(1-naphthyloxy)-5-nitro-pyrimidin-4-amine CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-6-(1-naphthalenyloxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-6-naphthalen-1-yloxy-5-nitropyrimidin-4-amine Traditional Name: [4-chloro-3-(trifluoromethyl)phenyl]-[6-(1-naphthoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C21H12ClF3N4O3 MolecularWeight: 460.79319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])NC4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])NC4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C21H12ClF3N4O3/c22-16-9-8-13(10-15(16)21(23,24)25)28-19-18(29(30)31)20(27-11-26-19)32-17-7-3-5-12-4-1-2-6-14(12)17/h1-11H,(H,26,27,28)