(4-ethyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethylsulfanyl)ethanoate

Systemtic Name: (4-ethyl-2-oxidanylidene-chromen-7-yl) 2-(phenylmethylsulfanyl)ethanoate Openeye Name: (4-ethyl-2-oxo-chromen-7-yl) 2-benzylsulfanylacetate CAS Name: 2-(phenylmethylthio)acetic acid (4-ethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-ethyl-2-oxochromen-7-yl) 2-benzylsulfanylacetate Traditional Name: 2-(benzylthio)acetic acid (4-ethyl-2-keto-chromen-7-yl) ester Formula: C20H18O4S MolecularWeight: 354.41952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CSCC3=CC=CC=C3

InChI

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