(Z)-3-methoxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]phenyl]prop-2-enoic acid

Systemtic Name: (Z)-3-methoxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]phenyl]prop-2-enoic acid Openeye Name: (Z)-3-methoxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]phenyl]prop-2-enoic acid CAS Name: (Z)-3-methoxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylthio]phenyl]-2-propenoic acid IUPAC Name: (Z)-3-methoxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylsulfanyl]phenyl]prop-2-enoic acid Traditional Name: (Z)-3-methoxy-2-[2-[(2-phenyl-1,3-dioxolan-2-yl)methylthio]phenyl]acrylic acid Formula: C20H20O5S MolecularWeight: 372.4348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CO/C=C(/C1=CC=CC=C1SCC2(OCCO2)C3=CC=CC=C3)\C(=O)O

InChI

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