4-methyl-2-[(1-oxidanidylpyridin-1-ium-2-yl)sulfonylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[(1-oxidanidylpyridin-1-ium-2-yl)sulfonylamino]pentanoic acid Openeye Name: 4-methyl-2-[(1-oxidopyridin-1-ium-2-yl)sulfonylamino]pentanoic acid CAS Name: 4-methyl-2-[(1-oxido-2-pyridin-1-iumyl)sulfonylamino]pentanoic acid IUPAC Name: 4-methyl-2-[(1-oxidopyridin-1-ium-2-yl)sulfonylamino]pentanoic acid Traditional Name: 4-methyl-2-[(1-oxidopyridin-1-ium-2-yl)sulfonylamino]valeric acid Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=CC=[N+]1[O-]

Isomeric SMILES

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=CC=[N+]1[O-]

InChI

InChI=1S/C11H16N2O5S/c1-8(2)7-9(11(14)15)12-19(17,18)10-5-3-4-6-13(10)16/h3-6,8-9,12H,7H2,1-2H3,(H,14,15)