2-[(4-iodophenyl)carbonylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[(4-iodophenyl)carbonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[(4-iodobenzoyl)amino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[(4-iodophenyl)-oxomethyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[(4-iodobenzoyl)amino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[(4-iodobenzoyl)amino]-4-mesyl-butyric acid Formula: C12H14INO5S MolecularWeight: 411.21273

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=CC=C(C=C1)I

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=CC=C(C=C1)I

InChI

InChI=1S/C12H14INO5S/c1-20(18,19)7-6-10(12(16)17)14-11(15)8-2-4-9(13)5-3-8/h2-5,10H,6-7H2,1H3,(H,14,15)(H,16,17)