3-[3-methoxy-4-(trifluoromethyl)phenyl]propane-1-thiol

Systemtic Name: 3-[3-methoxy-4-(trifluoromethyl)phenyl]propane-1-thiol Openeye Name: 3-[3-methoxy-4-(trifluoromethyl)phenyl]propane-1-thiol CAS Name: 3-[3-methoxy-4-(trifluoromethyl)phenyl]-1-propanethiol IUPAC Name: 3-[3-methoxy-4-(trifluoromethyl)phenyl]propane-1-thiol Traditional Name: 3-[3-methoxy-4-(trifluoromethyl)phenyl]propane-1-thiol Formula: C11H13F3OS MolecularWeight: 250.28053

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCCS)C(F)(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CCCS)C(F)(F)F

InChI

InChI=1S/C11H13F3OS/c1-15-10-7-8(3-2-6-16)4-5-9(10)11(12,13)14/h4-5,7,16H,2-3,6H2,1H3