3-[(4-methoxyphenyl)sulfonyl-[3-methyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]amino]propanoic acid

Systemtic Name: 3-[(4-methoxyphenyl)sulfonyl-[3-methyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]amino]propanoic acid Openeye Name: 3-[[1-(hydroxycarbamoyl)-2-methyl-propyl]-(4-methoxyphenyl)sulfonyl-amino]propanoic acid CAS Name: 3-[[1-(hydroxyamino)-3-methyl-1-oxobutan-2-yl]-(4-methoxyphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[[1-(hydroxyamino)-3-methyl-1-oxobutan-2-yl]-(4-methoxyphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[[1-(hydroxycarbamoyl)-2-methyl-propyl]-(4-methoxyphenyl)sulfonyl-amino]propionic acid Formula: C15H22N2O7S MolecularWeight: 374.40938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NO)N(CCC(=O)O)S(=O)(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)C(C(=O)NO)N(CCC(=O)O)S(=O)(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C15H22N2O7S/c1-10(2)14(15(20)16-21)17(9-8-13(18)19)25(22,23)12-6-4-11(24-3)5-7-12/h4-7,10,14,21H,8-9H2,1-3H3,(H,16,20)(H,18,19)