(3-fluoranyl-4-methoxy-phenyl)methyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C19H19BrFNO6S MolecularWeight: 488.324663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCOCC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N3CCOCC3)F

InChI

InChI=1S/C19H19BrFNO6S/c1-26-17-5-2-13(10-16(17)21)12-28-19(23)14-3-4-15(20)18(11-14)29(24,25)22-6-8-27-9-7-22/h2-5,10-11H,6-9,12H2,1H3