2-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid CAS Name: 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-3,4,5-trimethoxybenzoic acid IUPAC Name: 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-3,4,5-trimethoxybenzoic acid Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-3,4,5-trimethoxy-benzoic acid Formula: C16H15ClFNO7S MolecularWeight: 419.809203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl)OC)OC

InChI

InChI=1S/C16H15ClFNO7S/c1-24-12-7-9(16(20)21)13(15(26-3)14(12)25-2)19-27(22,23)8-4-5-11(18)10(17)6-8/h4-7,19H,1-3H3,(H,20,21)