(3-fluoranyl-4-methoxy-phenyl)methyl 3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 3-(benzylsulfamoyl)benzoate CAS Name: 3-[(phenylmethyl)sulfamoyl]benzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 3-(benzylsulfamoyl)benzoate Traditional Name: 3-(benzylsulfamoyl)benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C22H20FNO5S MolecularWeight: 429.461303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3)F

InChI

InChI=1S/C22H20FNO5S/c1-28-21-11-10-17(12-20(21)23)15-29-22(25)18-8-5-9-19(13-18)30(26,27)24-14-16-6-3-2-4-7-16/h2-13,24H,14-15H2,1H3