1-(3-fluorophenyl)butane-1,3-dione; 3-methylsulfanylpropan-1-amine

Systemtic Name: 1-(3-fluorophenyl)butane-1,3-dione; 3-methylsulfanylpropan-1-amine Openeye Name: 1-(3-fluorophenyl)butane-1,3-dione; 3-methylsulfanylpropan-1-amine CAS Name: 1-(3-fluorophenyl)butane-1,3-dione; 3-(methylthio)-1-propanamine IUPAC Name: 1-(3-fluorophenyl)butane-1,3-dione; 3-methylsulfanylpropan-1-amine Traditional Name: 1-(3-fluorophenyl)butane-1,3-dione; 3-(methylthio)propylamine Formula: C14H20FNO2S MolecularWeight: 285.377503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=CC(=CC=C1)F.CSCCCN

Isomeric SMILES

CC(=O)CC(=O)C1=CC(=CC=C1)F.CSCCCN

InChI

InChI=1S/C10H9FO2.C4H11NS/c1-7(12)5-10(13)8-3-2-4-9(11)6-8;1-6-4-2-3-5/h2-4,6H,5H2,1H3;2-5H2,1H3