2-[(1-ethylsulfonylpiperidin-4-yl)carbonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(1-ethylsulfonylpiperidin-4-yl)carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(1-ethylsulfonylpiperidine-4-carbonyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[(1-ethylsulfonyl-4-piperidinyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(1-ethylsulfonylpiperidine-4-carbonyl)amino]-3-methylbutanoic acid Traditional Name: 2-[(1-esylisonipecotoyl)amino]-3-methyl-butyric acid Formula: C13H24N2O5S MolecularWeight: 320.40506

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C13H24N2O5S/c1-4-21(19,20)15-7-5-10(6-8-15)12(16)14-11(9(2)3)13(17)18/h9-11H,4-8H2,1-3H3,(H,14,16)(H,17,18)