methyl (E)-3-oxidanyl-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-oxidanyl-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-hydroxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]phenyl]prop-2-enoate CAS Name: (E)-3-hydroxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylthio]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-hydroxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]phenyl]prop-2-enoate Traditional Name: (E)-3-hydroxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylthio]phenyl]acrylic acid methyl ester Formula: C20H20O5S MolecularWeight: 372.4348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CO)C1=CC=CC=C1SCC2(OCCO2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)/C(=C/O)/C1=CC=CC=C1SCC2(OCCO2)C3=CC=CC=C3

InChI

InChI=1S/C20H20O5S/c1-23-19(22)17(13-21)16-9-5-6-10-18(16)26-14-20(24-11-12-25-20)15-7-3-2-4-8-15/h2-10,13,21H,11-12,14H2,1H3/b17-13+