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

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-phenylsulfanylpropanoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic 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:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16O5S/c20-14-6-7-16-13(10-19(22)24-17(16)11-14)12-23-18(21)8-9-25-15-4-2-1-3-5-15/h1-7,10-11,20H,8-9,12H2