4-(2-fluoranyloctoxy)benzenecarbothioic S-acid

Systemtic Name: 4-(2-fluoranyloctoxy)benzenecarbothioic S-acid Openeye Name: 4-(2-fluorooctoxy)benzenecarbothioic S-acid CAS Name: 4-(2-fluorooctoxy)benzenecarbothioic S-acid IUPAC Name: 4-(2-fluorooctoxy)benzenecarbothioic S-acid Traditional Name: 4-(2-fluorooctoxy)thiobenzoic acid Formula: C15H21FO2S MolecularWeight: 284.389443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(COC1=CC=C(C=C1)C(=O)S)F

Isomeric SMILES

CCCCCCC(COC1=CC=C(C=C1)C(=O)S)F

InChI

InChI=1S/C15H21FO2S/c1-2-3-4-5-6-13(16)11-18-14-9-7-12(8-10-14)15(17)19/h7-10,13H,2-6,11H2,1H3,(H,17,19)