(4-ethyl-2-oxidanylidene-chromen-7-yl) 4-(methylsulfanylmethyl)benzoate

Systemtic Name: (4-ethyl-2-oxidanylidene-chromen-7-yl) 4-(methylsulfanylmethyl)benzoate Openeye Name: (4-ethyl-2-oxo-chromen-7-yl) 4-(methylsulfanylmethyl)benzoate CAS Name: 4-[(methylthio)methyl]benzoic acid (4-ethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-ethyl-2-oxochromen-7-yl) 4-(methylsulfanylmethyl)benzoate Traditional Name: 4-[(methylthio)methyl]benzoic acid (4-ethyl-2-keto-chromen-7-yl) ester Formula: C20H18O4S MolecularWeight: 354.41952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3=CC=C(C=C3)CSC

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3=CC=C(C=C3)CSC

InChI

InChI=1S/C20H18O4S/c1-3-14-10-19(21)24-18-11-16(8-9-17(14)18)23-20(22)15-6-4-13(5-7-15)12-25-2/h4-11H,3,12H2,1-2H3