2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid

Systemtic Name: 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Openeye Name: 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid CAS Name: 2-[(4-bromo-2-chlorophenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid IUPAC Name: 2-[(4-bromo-2-chlorophenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Traditional Name: 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid Formula: C17H17BrClNO7S MolecularWeight: 494.74138

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=C(C=C(C=C2)Br)Cl)C(=O)O)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=C(C=C(C=C2)Br)Cl)C(=O)O)OC

InChI

InChI=1S/C17H17BrClNO7S/c1-25-5-6-27-15-9-13(11(17(21)22)8-14(15)26-2)20-28(23,24)16-4-3-10(18)7-12(16)19/h3-4,7-9,20H,5-6H2,1-2H3,(H,21,22)