(2-chloranyl-6-fluoranyl-phenyl)methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propionic acid (2-chloro-6-fluoro-benzyl) ester Formula: C18H16ClFO6S MolecularWeight: 414.832443

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H16ClFO6S/c19-14-2-1-3-15(20)13(14)11-26-18(21)6-9-27(22,23)12-4-5-16-17(10-12)25-8-7-24-16/h1-5,10H,6-9,11H2