2-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]hexanoic acid

Systemtic Name: 2-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]hexanoic acid Openeye Name: 2-[(1-methylsulfonylpiperidine-4-carbonyl)amino]hexanoic acid CAS Name: 2-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 2-[(1-methylsulfonylpiperidine-4-carbonyl)amino]hexanoic acid Traditional Name: 2-[(1-mesylisonipecotoyl)amino]hexanoic acid Formula: C13H24N2O5S MolecularWeight: 320.40506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)C

InChI

InChI=1S/C13H24N2O5S/c1-3-4-5-11(13(17)18)14-12(16)10-6-8-15(9-7-10)21(2,19)20/h10-11H,3-9H2,1-2H3,(H,14,16)(H,17,18)