(4-ethyl-2-oxidanylidene-chromen-7-yl) 4-methylsulfanylbenzoate

Systemtic Name: (4-ethyl-2-oxidanylidene-chromen-7-yl) 4-methylsulfanylbenzoate Openeye Name: (4-ethyl-2-oxo-chromen-7-yl) 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid (4-ethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-ethyl-2-oxochromen-7-yl) 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid (4-ethyl-2-keto-chromen-7-yl) ester Formula: C19H16O4S MolecularWeight: 340.39294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16O4S/c1-3-12-10-18(20)23-17-11-14(6-9-16(12)17)22-19(21)13-4-7-15(24-2)8-5-13/h4-11H,3H2,1-2H3