ethyl 3-[(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylamino]-4-(ethylamino)benzoate

Systemtic Name: ethyl 3-[(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylamino]-4-(ethylamino)benzoate Openeye Name: ethyl 3-[(2-bromo-4,5-dimethoxy-phenyl)sulfonylamino]-4-(ethylamino)benzoate CAS Name: 3-[(2-bromo-4,5-dimethoxyphenyl)sulfonylamino]-4-(ethylamino)benzoic acid ethyl ester IUPAC Name: ethyl 3-[(2-bromo-4,5-dimethoxyphenyl)sulfonylamino]-4-(ethylamino)benzoate Traditional Name: 3-[(2-bromo-4,5-dimethoxy-phenyl)sulfonylamino]-4-(ethylamino)benzoic acid ethyl ester Formula: C19H23BrN2O6S MolecularWeight: 487.36472

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)OCC)NS(=O)(=O)C2=C(C=C(C(=C2)OC)OC)Br

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(=O)OCC)NS(=O)(=O)C2=C(C=C(C(=C2)OC)OC)Br

InChI

InChI=1S/C19H23BrN2O6S/c1-5-21-14-8-7-12(19(23)28-6-2)9-15(14)22-29(24,25)18-11-17(27-4)16(26-3)10-13(18)20/h7-11,21-22H,5-6H2,1-4H3