(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-methylsulfanylbenzoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-methylsulfanylbenzoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 4-methylsulfanylbenzoate CAS Name: 4-(methylthio)benzoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 4-methylsulfanylbenzoate Traditional Name: 4-(methylthio)benzoic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C18H14O5S MolecularWeight: 342.36576

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C18H14O5S/c1-24-14-5-2-11(3-6-14)18(21)22-10-12-8-17(20)23-16-9-13(19)4-7-15(12)16/h2-9,19H,10H2,1H3