3-nitro-4-[3-(trifluoromethyl)phenyl]sulfanyl-benzaldehyde

Systemtic Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]sulfanyl-benzaldehyde Openeye Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]sulfanyl-benzaldehyde CAS Name: 3-nitro-4-[[3-(trifluoromethyl)phenyl]thio]benzaldehyde IUPAC Name: 3-nitro-4-[3-(trifluoromethyl)phenyl]sulfanylbenzaldehyde Traditional Name: 3-nitro-4-[[3-(trifluoromethyl)phenyl]thio]benzaldehyde Formula: C14H8F3NO3S MolecularWeight: 327.27843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)C=O)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)C=O)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C14H8F3NO3S/c15-14(16,17)10-2-1-3-11(7-10)22-13-5-4-9(8-19)6-12(13)18(20)21/h1-8H