3-chloranyl-2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(trifluoromethyl)pyridine

Systemtic Name: 3-chloranyl-2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(trifluoromethyl)pyridine Openeye Name: 3-chloro-2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(trifluoromethyl)pyridine CAS Name: 3-chloro-2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-5-(trifluoromethyl)pyridine IUPAC Name: 3-chloro-2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(trifluoromethyl)pyridine Traditional Name: 3-chloro-2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-5-(trifluoromethyl)pyridine Formula: C15H10ClF3N2O4S MolecularWeight: 406.76411

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=C(C=C(C=N3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=C(C=C(C=N3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H10ClF3N2O4S/c16-12-3-10(15(17,18)19)4-20-14(12)26-6-9-2-11(21(22)23)1-8-5-24-7-25-13(8)9/h1-4H,5-7H2