4-[bis(fluoranyl)methoxy]-2-[(3-bromanyl-4-methoxy-phenyl)sulfonylamino]-5-methoxy-benzoic acid

Systemtic Name: 4-[bis(fluoranyl)methoxy]-2-[(3-bromanyl-4-methoxy-phenyl)sulfonylamino]-5-methoxy-benzoic acid Openeye Name: 2-[(3-bromo-4-methoxy-phenyl)sulfonylamino]-4-(difluoromethoxy)-5-methoxy-benzoic acid CAS Name: 2-[(3-bromo-4-methoxyphenyl)sulfonylamino]-4-(difluoromethoxy)-5-methoxybenzoic acid IUPAC Name: 2-[(3-bromo-4-methoxyphenyl)sulfonylamino]-4-(difluoromethoxy)-5-methoxybenzoic acid Traditional Name: 2-[(3-bromo-4-methoxy-phenyl)sulfonylamino]-4-(difluoromethoxy)-5-methoxy-benzoic acid Formula: C16H14BrF2NO7S MolecularWeight: 482.250666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)O)OC)OC(F)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)O)OC)OC(F)F)Br

InChI

InChI=1S/C16H14BrF2NO7S/c1-25-12-4-3-8(5-10(12)17)28(23,24)20-11-7-14(27-16(18)19)13(26-2)6-9(11)15(21)22/h3-7,16,20H,1-2H3,(H,21,22)