1,1,1-tris(fluoranyl)-3-oxidanyl-4-(phenoxymethylsulfanyl)butan-2-one

Systemtic Name: 1,1,1-tris(fluoranyl)-3-oxidanyl-4-(phenoxymethylsulfanyl)butan-2-one Openeye Name: 1,1,1-trifluoro-3-hydroxy-4-(phenoxymethylsulfanyl)butan-2-one CAS Name: 1,1,1-trifluoro-3-hydroxy-4-(phenoxymethylthio)-2-butanone IUPAC Name: 1,1,1-trifluoro-3-hydroxy-4-(phenoxymethylsulfanyl)butan-2-one Traditional Name: 1,1,1-trifluoro-3-hydroxy-4-(phenoxymethylthio)butan-2-one Formula: C11H11F3O3S MolecularWeight: 280.26345

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCSCC(C(=O)C(F)(F)F)O

Isomeric SMILES

C1=CC=C(C=C1)OCSCC(C(=O)C(F)(F)F)O

InChI

InChI=1S/C11H11F3O3S/c12-11(13,14)10(16)9(15)6-18-7-17-8-4-2-1-3-5-8/h1-5,9,15H,6-7H2