2-[[4-(4-iodophenyl)phenyl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[4-(4-iodophenyl)phenyl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[[4-(4-iodophenyl)phenyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[[4-(4-iodophenyl)phenyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[[4-(4-iodophenyl)phenyl]sulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[[4-(4-iodophenyl)phenyl]sulfonylamino]-3-methyl-butyric acid Formula: C17H18INO4S MolecularWeight: 459.29859

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)I

Isomeric SMILES

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)I

InChI

InChI=1S/C17H18INO4S/c1-11(2)16(17(20)21)19-24(22,23)15-9-5-13(6-10-15)12-3-7-14(18)8-4-12/h3-11,16,19H,1-2H3,(H,20,21)