3-[2,6-dinitro-3-phenoxy-4-(trifluoromethyl)phenyl]pyrrolidine

Systemtic Name: 3-[2,6-dinitro-3-phenoxy-4-(trifluoromethyl)phenyl]pyrrolidine Openeye Name: 3-[2,6-dinitro-3-phenoxy-4-(trifluoromethyl)phenyl]pyrrolidine CAS Name: 3-[2,6-dinitro-3-phenoxy-4-(trifluoromethyl)phenyl]pyrrolidine IUPAC Name: 3-[2,6-dinitro-3-phenoxy-4-(trifluoromethyl)phenyl]pyrrolidine Traditional Name: 3-[2,6-dinitro-3-phenoxy-4-(trifluoromethyl)phenyl]pyrrolidine Formula: C17H14F3N3O5 MolecularWeight: 397.30537

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C2=C(C=C(C(=C2[N+](=O)[O-])OC3=CC=CC=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CNCC1C2=C(C=C(C(=C2[N+](=O)[O-])OC3=CC=CC=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H14F3N3O5/c18-17(19,20)12-8-13(22(24)25)14(10-6-7-21-9-10)15(23(26)27)16(12)28-11-4-2-1-3-5-11/h1-5,8,10,21H,6-7,9H2