4-[(4-fluoranyl-3-methoxycarbonyl-phenyl)sulfamoyl]butanoic acid

Systemtic Name: 4-[(4-fluoranyl-3-methoxycarbonyl-phenyl)sulfamoyl]butanoic acid Openeye Name: 4-[(4-fluoro-3-methoxycarbonyl-phenyl)sulfamoyl]butanoic acid CAS Name: 4-[(4-fluoro-3-methoxycarbonylphenyl)sulfamoyl]butanoic acid IUPAC Name: 4-[(4-fluoro-3-methoxycarbonylphenyl)sulfamoyl]butanoic acid Traditional Name: 4-[(3-carbomethoxy-4-fluoro-phenyl)sulfamoyl]butyric acid Formula: C12H14FNO6S MolecularWeight: 319.306063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NS(=O)(=O)CCCC(=O)O)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NS(=O)(=O)CCCC(=O)O)F

InChI

InChI=1S/C12H14FNO6S/c1-20-12(17)9-7-8(4-5-10(9)13)14-21(18,19)6-2-3-11(15)16/h4-5,7,14H,2-3,6H2,1H3,(H,15,16)