ethyl (2S,3S)-4-iodanyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: ethyl (2S,3S)-4-iodanyl-2-methyl-3-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: ethyl (2S,3S)-4-iodo-2-methyl-3-(p-tolylsulfonylamino)butanoate CAS Name: (2S,3S)-4-iodo-2-methyl-3-[(4-methylphenyl)sulfonylamino]butanoic acid ethyl ester IUPAC Name: ethyl (2S,3S)-4-iodo-2-methyl-3-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: (2S,3S)-4-iodo-2-methyl-3-(tosylamino)butyric acid ethyl ester Formula: C14H20INO4S MolecularWeight: 425.28237

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C(CI)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCOC(=O)[C@@H](C)[C@@H](CI)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C14H20INO4S/c1-4-20-14(17)11(3)13(9-15)16-21(18,19)12-7-5-10(2)6-8-12/h5-8,11,13,16H,4,9H2,1-3H3/t11-,13+/m0/s1