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sulfanyl 3-butyl-2-propyl-4-(trifluoromethyl)benzoate

sulfanyl 3-butyl-2-propyl-4-(trifluoromethyl)benzoate

Systemtic Name:sulfanyl 3-butyl-2-propyl-4-(trifluoromethyl)benzoate
Openeye Name:sulfanyl 3-butyl-2-propyl-4-(trifluoromethyl)benzoate
CAS Name:3-butyl-2-propyl-4-(trifluoromethyl)benzoic acid mercapto ester
IUPAC Name:sulfanyl 3-butyl-2-propyl-4-(trifluoromethyl)benzoate
Traditional Name:3-butyl-2-propyl-4-(trifluoromethyl)benzoic acid mercapto ester
Formula: C15H19F3O2S
MolecularWeight: 320.37037
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1CCC)C(=O)OS)C(F)(F)F


Isomeric SMILES

CCCCC1=C(C=CC(=C1CCC)C(=O)OS)C(F)(F)F


InChI

InChI=1S/C15H19F3O2S/c1-3-5-7-11-10(6-4-2)12(14(19)20-21)8-9-13(11)15(16,17)18/h8-9,21H,3-7H2,1-2H3


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