ethyl 2-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: ethyl 2-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: ethyl 2-[(3,5-dichloro-2-hydroxy-phenyl)sulfonylamino]-6-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[(3,5-dichloro-2-hydroxyphenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(3,5-dichloro-2-hydroxyphenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2-[(3,5-dichloro-2-hydroxy-phenyl)sulfonylamino]-6-(tosylamino)hexanoic acid ethyl ester Formula: C21H26Cl2N2O7S2 MolecularWeight: 553.47634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC(=CC(=C2O)Cl)Cl

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC(=CC(=C2O)Cl)Cl

InChI

InChI=1S/C21H26Cl2N2O7S2/c1-3-32-21(27)18(25-34(30,31)19-13-15(22)12-17(23)20(19)26)6-4-5-11-24-33(28,29)16-9-7-14(2)8-10-16/h7-10,12-13,18,24-26H,3-6,11H2,1-2H3