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

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoate Openeye Name: (2-chloro-4-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-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-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-4-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=C(C=C3)F)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)CCC(=O)OCC3=C(C=C(C=C3)F)Cl

InChI

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