(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C20H17FO5S MolecularWeight: 388.409383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C20H17FO5S/c1-24-15-4-7-17-13(10-20(23)26-18(17)11-15)12-25-19(22)8-9-27-16-5-2-14(21)3-6-16/h2-7,10-11H,8-9,12H2,1H3