(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-methoxyphenyl)sulfanylethanoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-methoxyphenyl)sulfanylethanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 2-(4-methoxyphenyl)sulfanylacetate CAS Name: 2-[(4-methoxyphenyl)thio]acetic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 2-(4-methoxyphenyl)sulfanylacetate Traditional Name: 2-[(4-methoxyphenyl)thio]acetic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C21H20O5S MolecularWeight: 384.4455

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H20O5S/c1-3-14-4-9-18-15(11-20(22)26-19(18)10-14)12-25-21(23)13-27-17-7-5-16(24-2)6-8-17/h4-11H,3,12-13H2,1-2H3