2-[2-(1-cyanoethoxy)-3-nitro-6-phenoxy-phenyl]-3-fluoranyl-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 2-[2-(1-cyanoethoxy)-3-nitro-6-phenoxy-phenyl]-3-fluoranyl-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-[2-(1-cyanoethoxy)-3-nitro-6-phenoxy-phenyl]-3-fluoro-5-(trifluoromethyl)benzonitrile CAS Name: 2-[2-(1-cyanoethoxy)-3-nitro-6-phenoxyphenyl]-3-fluoro-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-[2-(1-cyanoethoxy)-3-nitro-6-phenoxyphenyl]-3-fluoro-5-(trifluoromethyl)benzonitrile Traditional Name: 2-[2-(1-cyanoethoxy)-3-nitro-6-phenoxy-phenyl]-3-fluoro-5-(trifluoromethyl)benzonitrile Formula: C23H13F4N3O4 MolecularWeight: 471.360633

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC1=C(C=CC(=C1C2=C(C=C(C=C2C#N)C(F)(F)F)F)OC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C#N)OC1=C(C=CC(=C1C2=C(C=C(C=C2C#N)C(F)(F)F)F)OC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H13F4N3O4/c1-13(11-28)33-22-18(30(31)32)7-8-19(34-16-5-3-2-4-6-16)21(22)20-14(12-29)9-15(10-17(20)24)23(25,26)27/h2-10,13H,1H3