2-[2-chloranyl-4-(trifluoromethyl)phenyl]-6-nitro-3-phenoxy-benzenecarbonitrile

Systemtic Name: 2-[2-chloranyl-4-(trifluoromethyl)phenyl]-6-nitro-3-phenoxy-benzenecarbonitrile Openeye Name: 2-[2-chloro-4-(trifluoromethyl)phenyl]-6-nitro-3-phenoxy-benzonitrile CAS Name: 2-[2-chloro-4-(trifluoromethyl)phenyl]-6-nitro-3-phenoxybenzonitrile IUPAC Name: 2-[2-chloro-4-(trifluoromethyl)phenyl]-6-nitro-3-phenoxybenzonitrile Traditional Name: 2-[2-chloro-4-(trifluoromethyl)phenyl]-6-nitro-3-phenoxy-benzonitrile Formula: C20H10ClF3N2O3 MolecularWeight: 418.75321

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C(=C(C=C2)[N+](=O)[O-])C#N)C3=C(C=C(C=C3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C(=C(C=C2)[N+](=O)[O-])C#N)C3=C(C=C(C=C3)C(F)(F)F)Cl

InChI

InChI=1S/C20H10ClF3N2O3/c21-16-10-12(20(22,23)24)6-7-14(16)19-15(11-25)17(26(27)28)8-9-18(19)29-13-4-2-1-3-5-13/h1-10H