N-(2-cyanoethyl)-2-nitro-5-[4-(trifluoromethyl)phenoxy]benzamide

Systemtic Name: N-(2-cyanoethyl)-2-nitro-5-[4-(trifluoromethyl)phenoxy]benzamide Openeye Name: N-(2-cyanoethyl)-2-nitro-5-[4-(trifluoromethyl)phenoxy]benzamide CAS Name: N-(2-cyanoethyl)-2-nitro-5-[4-(trifluoromethyl)phenoxy]benzamide IUPAC Name: N-(2-cyanoethyl)-2-nitro-5-[4-(trifluoromethyl)phenoxy]benzamide Traditional Name: N-(2-cyanoethyl)-2-nitro-5-[4-(trifluoromethyl)phenoxy]benzamide Formula: C17H12F3N3O4 MolecularWeight: 379.29009

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)NCCC#N

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)NCCC#N

InChI

InChI=1S/C17H12F3N3O4/c18-17(19,20)11-2-4-12(5-3-11)27-13-6-7-15(23(25)26)14(10-13)16(24)22-9-1-8-21/h2-7,10H,1,9H2,(H,22,24)