2-[(4-methylsulfonylphenyl)methyl]-5-(oxidanylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-[(4-methylsulfonylphenyl)methyl]-5-(oxidanylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(hydroxyamino)-2-[(4-methylsulfonylphenyl)methyl]-5-oxo-pentanoic acid CAS Name: 5-(hydroxyamino)-2-[(4-methylsulfonylphenyl)methyl]-5-oxopentanoic acid IUPAC Name: 5-(hydroxyamino)-2-[(4-methylsulfonylphenyl)methyl]-5-oxopentanoic acid Traditional Name: 5-(hydroxyamino)-5-keto-2-(4-mesylbenzyl)valeric acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC(CCC(=O)NO)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC(CCC(=O)NO)C(=O)O

InChI

InChI=1S/C13H17NO6S/c1-21(19,20)11-5-2-9(3-6-11)8-10(13(16)17)4-7-12(15)14-18/h2-3,5-6,10,18H,4,7-8H2,1H3,(H,14,15)(H,16,17)