(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(methylsulfanylmethyl)benzoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-(methylsulfanylmethyl)benzoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 3-(methylsulfanylmethyl)benzoate CAS Name: 3-[(methylthio)methyl]benzoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 3-(methylsulfanylmethyl)benzoate Traditional Name: 3-[(methylthio)methyl]benzoic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C19H16O5S MolecularWeight: 356.39234

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CSCC1=CC=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C19H16O5S/c1-25-11-12-3-2-4-13(7-12)19(22)23-10-14-8-18(21)24-17-9-15(20)5-6-16(14)17/h2-9,20H,10-11H2,1H3