(3-methylphenyl)methyl 5-(dimethylsulfamoyl)-2-fluoranyl-benzoate

Systemtic Name: (3-methylphenyl)methyl 5-(dimethylsulfamoyl)-2-fluoranyl-benzoate Openeye Name: m-tolylmethyl 5-(dimethylsulfamoyl)-2-fluoro-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-fluorobenzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 5-(dimethylsulfamoyl)-2-fluorobenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-fluoro-benzoic acid (3-methylbenzyl) ester Formula: C17H18FNO4S MolecularWeight: 351.392523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)F

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)F

InChI

InChI=1S/C17H18FNO4S/c1-12-5-4-6-13(9-12)11-23-17(20)15-10-14(7-8-16(15)18)24(21,22)19(2)3/h4-10H,11H2,1-3H3