(4-bromanyl-2-fluoranyl-phenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(3-chlorophenyl)sulfonylamino]propanoic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-chlorophenyl)sulfonylamino]propionic acid (4-bromo-2-fluoro-benzyl) ester Formula: C16H14BrClFNO4S MolecularWeight: 450.707063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)S(=O)(=O)NCCC(=O)OCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1=CC(=CC(=C1)Cl)S(=O)(=O)NCCC(=O)OCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H14BrClFNO4S/c17-12-5-4-11(15(19)8-12)10-24-16(21)6-7-20-25(22,23)14-3-1-2-13(18)9-14/h1-5,8-9,20H,6-7,10H2