methyl 2-[(4-iodophenyl)sulfonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[(4-iodophenyl)sulfonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[(4-iodophenyl)sulfonylamino]-4-methyl-pentanoate CAS Name: 2-[(4-iodophenyl)sulfonylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(4-iodophenyl)sulfonylamino]-4-methylpentanoate Traditional Name: 2-[(4-iodophenyl)sulfonylamino]-4-methyl-valeric acid methyl ester Formula: C13H18INO4S MolecularWeight: 411.25579

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18INO4S/c1-9(2)8-12(13(16)19-3)15-20(17,18)11-6-4-10(14)5-7-11/h4-7,9,12,15H,8H2,1-3H3