ethyl 2-[(5-fluoranyl-2-methyl-phenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: ethyl 2-[(5-fluoranyl-2-methyl-phenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: ethyl 2-[(5-fluoro-2-methyl-phenyl)sulfonylamino]-6-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[(5-fluoro-2-methylphenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(5-fluoro-2-methylphenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2-[(5-fluoro-2-methyl-phenyl)sulfonylamino]-6-(tosylamino)hexanoic acid ethyl ester Formula: C22H29FN2O6S2 MolecularWeight: 500.603863

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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=C(C=CC(=C2)F)C

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=C(C=CC(=C2)F)C

InChI

InChI=1S/C22H29FN2O6S2/c1-4-31-22(26)20(25-33(29,30)21-15-18(23)11-10-17(21)3)7-5-6-14-24-32(27,28)19-12-8-16(2)9-13-19/h8-13,15,20,24-25H,4-7,14H2,1-3H3