2,2-dimethyl-7-[4-nitro-3-(trifluoromethyl)phenoxy]-3H-1-benzofuran

Systemtic Name: 2,2-dimethyl-7-[4-nitro-3-(trifluoromethyl)phenoxy]-3H-1-benzofuran Openeye Name: 2,2-dimethyl-7-[4-nitro-3-(trifluoromethyl)phenoxy]-3H-benzofuran CAS Name: 2,2-dimethyl-7-[4-nitro-3-(trifluoromethyl)phenoxy]-3H-benzofuran IUPAC Name: 2,2-dimethyl-7-[4-nitro-3-(trifluoromethyl)phenoxy]-3H-1-benzofuran Traditional Name: 2,2-dimethyl-7-[4-nitro-3-(trifluoromethyl)phenoxy]coumaran Formula: C17H14F3NO4 MolecularWeight: 353.29257

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OC3=CC(=C(C=C3)[N+](=O)[O-])C(F)(F)F)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OC3=CC(=C(C=C3)[N+](=O)[O-])C(F)(F)F)C

InChI

InChI=1S/C17H14F3NO4/c1-16(2)9-10-4-3-5-14(15(10)25-16)24-11-6-7-13(21(22)23)12(8-11)17(18,19)20/h3-8H,9H2,1-2H3