3-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]oxolane

Systemtic Name: 3-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]oxolane Openeye Name: 3-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]tetrahydrofuran CAS Name: 3-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]oxolane IUPAC Name: 3-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]oxolane Traditional Name: 3-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]tetrahydrofuran Formula: C34H26Cl2F6N2O10 MolecularWeight: 807.474059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC1OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-].C1COCC1OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCC1OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-].C1COCC1OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/2C17H13ClF3NO5/c2*18-13-7-10(17(19,20)21)1-4-15(13)26-11-2-3-14(22(23)24)16(8-11)27-12-5-6-25-9-12/h2*1-4,7-8,12H,5-6,9H2