(3,3-dimethyl-2-oxidanylidene-butyl) 2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanoate CAS Name: 2-[(4-bromophenyl)sulfonylamino]-3-methylbutanoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[(4-bromophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: 2-(brosylamino)-3-methyl-butyric acid (2-keto-3,3-dimethyl-butyl) ester Formula: C17H24BrNO5S MolecularWeight: 434.34516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C(C)(C)C)NS(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)C(C)(C)C)NS(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C17H24BrNO5S/c1-11(2)15(16(21)24-10-14(20)17(3,4)5)19-25(22,23)13-8-6-12(18)7-9-13/h6-9,11,15,19H,10H2,1-5H3