3-[(3,4-dimethoxyphenyl)methylsulfamoyl]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methylsulfamoyl]-4-fluoranyl-benzoic acid Openeye Name: 3-[(3,4-dimethoxyphenyl)methylsulfamoyl]-4-fluoro-benzoic acid CAS Name: 3-[(3,4-dimethoxyphenyl)methylsulfamoyl]-4-fluorobenzoic acid IUPAC Name: 3-[(3,4-dimethoxyphenyl)methylsulfamoyl]-4-fluorobenzoic acid Traditional Name: 4-fluoro-3-(veratrylsulfamoyl)benzoic acid Formula: C16H16FNO6S MolecularWeight: 369.364743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F)OC

InChI

InChI=1S/C16H16FNO6S/c1-23-13-6-3-10(7-14(13)24-2)9-18-25(21,22)15-8-11(16(19)20)4-5-12(15)17/h3-8,18H,9H2,1-2H3,(H,19,20)