2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(2-methylpropoxycarbonylamino)hexanoic acid

Systemtic Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(2-methylpropoxycarbonylamino)hexanoic acid Openeye Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(isobutoxycarbonylamino)hexanoic acid CAS Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-[[2-methylpropoxy(oxo)methyl]amino]hexanoic acid IUPAC Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(2-methylpropoxycarbonylamino)hexanoic acid Traditional Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(isobutoxycarbonylamino)hexanoic acid Formula: C23H29BrN2O6S MolecularWeight: 541.45516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)NCCCCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)COC(=O)NCCCCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C23H29BrN2O6S/c1-16(2)15-32-23(29)25-14-4-3-5-21(22(27)28)26-33(30,31)20-12-8-18(9-13-20)17-6-10-19(24)11-7-17/h6-13,16,21,26H,3-5,14-15H2,1-2H3,(H,25,29)(H,27,28)