(4Z)-4-[[4-nitro-2-(trifluoromethyl)phenyl]methylidene]-1-octadecyl-quinoline

Systemtic Name: (4Z)-4-[[4-nitro-2-(trifluoromethyl)phenyl]methylidene]-1-octadecyl-quinoline Openeye Name: (4Z)-4-[[4-nitro-2-(trifluoromethyl)phenyl]methylene]-1-octadecyl-quinoline CAS Name: (4Z)-4-[[4-nitro-2-(trifluoromethyl)phenyl]methylidene]-1-octadecylquinoline IUPAC Name: (4Z)-4-[[4-nitro-2-(trifluoromethyl)phenyl]methylidene]-1-octadecylquinoline Traditional Name: (4Z)-4-[4-nitro-2-(trifluoromethyl)benzylidene]-1-stearyl-quinoline Formula: C35H47F3N2O2 MolecularWeight: 584.75509

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C=CC(=CC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)C3=CC=CC=C31

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C=C/C(=C/C2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)/C3=CC=CC=C31

InChI

InChI=1S/C35H47F3N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25-39-26-24-29(32-20-17-18-21-34(32)39)27-30-22-23-31(40(41)42)28-33(30)35(36,37)38/h17-18,20-24,26-28H,2-16,19,25H2,1H3/b29-27-