ethyl 2-[(2-bromophenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: ethyl 2-[(2-bromophenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: ethyl 2-[(2-bromophenyl)sulfonylamino]-6-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[(2-bromophenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-bromophenyl)sulfonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2-[(2-bromophenyl)sulfonylamino]-6-(tosylamino)hexanoic acid ethyl ester Formula: C21H27BrN2O6S2 MolecularWeight: 547.48288

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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=C2Br

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C21H27BrN2O6S2/c1-3-30-21(25)19(24-32(28,29)20-10-5-4-8-18(20)22)9-6-7-15-23-31(26,27)17-13-11-16(2)12-14-17/h4-5,8,10-14,19,23-24H,3,6-7,9,15H2,1-2H3