(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-phenylsulfanylethanoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 2-phenylsulfanylethanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C20H18O4S MolecularWeight: 354.41952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18O4S/c1-2-14-8-9-17-15(11-19(21)24-18(17)10-14)12-23-20(22)13-25-16-6-4-3-5-7-16/h3-11H,2,12-13H2,1H3