1-(4-chlorophenyl)sulfanyl-2-[5-nitro-6-(trifluoromethyl)-1-benzofuran-2-yl]propan-2-ol

Systemtic Name: 1-(4-chlorophenyl)sulfanyl-2-[5-nitro-6-(trifluoromethyl)-1-benzofuran-2-yl]propan-2-ol Openeye Name: 1-(4-chlorophenyl)sulfanyl-2-[5-nitro-6-(trifluoromethyl)benzofuran-2-yl]propan-2-ol CAS Name: 1-[(4-chlorophenyl)thio]-2-[5-nitro-6-(trifluoromethyl)-2-benzofuranyl]-2-propanol IUPAC Name: 1-(4-chlorophenyl)sulfanyl-2-[5-nitro-6-(trifluoromethyl)-1-benzofuran-2-yl]propan-2-ol Traditional Name: 1-[(4-chlorophenyl)thio]-2-[5-nitro-6-(trifluoromethyl)benzofuran-2-yl]propan-2-ol Formula: C18H13ClF3NO4S MolecularWeight: 431.81333

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=C(C=C1)Cl)(C2=CC3=CC(=C(C=C3O2)C(F)(F)F)[N+](=O)[O-])O

Isomeric SMILES

CC(CSC1=CC=C(C=C1)Cl)(C2=CC3=CC(=C(C=C3O2)C(F)(F)F)[N+](=O)[O-])O

InChI

InChI=1S/C18H13ClF3NO4S/c1-17(24,9-28-12-4-2-11(19)3-5-12)16-7-10-6-14(23(25)26)13(18(20,21)22)8-15(10)27-16/h2-8,24H,9H2,1H3