4-cyano-4-(1,3-dithian-2-yl)-3-(fluoranylmethyl)-2-methyl-butanoic acid

Systemtic Name: 4-cyano-4-(1,3-dithian-2-yl)-3-(fluoranylmethyl)-2-methyl-butanoic acid Openeye Name: 4-cyano-4-(1,3-dithian-2-yl)-3-(fluoromethyl)-2-methyl-butanoic acid CAS Name: 4-cyano-4-(1,3-dithian-2-yl)-3-(fluoromethyl)-2-methylbutanoic acid IUPAC Name: 4-cyano-4-(1,3-dithian-2-yl)-3-(fluoromethyl)-2-methylbutanoic acid Traditional Name: 4-cyano-4-(1,3-dithian-2-yl)-3-(fluoromethyl)-2-methyl-butyric acid Formula: C11H16FNO2S2 MolecularWeight: 277.378643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CF)C(C#N)C1SCCCS1)C(=O)O

Isomeric SMILES

CC(C(CF)C(C#N)C1SCCCS1)C(=O)O

InChI

InChI=1S/C11H16FNO2S2/c1-7(10(14)15)8(5-12)9(6-13)11-16-3-2-4-17-11/h7-9,11H,2-5H2,1H3,(H,14,15)