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

Systemtic Name: 2-[(1-ethylsulfonylpiperidin-4-yl)carbonylamino]butanoic acid Openeye Name: 2-[(1-ethylsulfonylpiperidine-4-carbonyl)amino]butanoic acid CAS Name: 2-[[(1-ethylsulfonyl-4-piperidinyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(1-ethylsulfonylpiperidine-4-carbonyl)amino]butanoic acid Traditional Name: 2-[(1-esylisonipecotoyl)amino]butyric acid Formula: C12H22N2O5S MolecularWeight: 306.37848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)CC

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)CC

InChI

InChI=1S/C12H22N2O5S/c1-3-10(12(16)17)13-11(15)9-5-7-14(8-6-9)20(18,19)4-2/h9-10H,3-8H2,1-2H3,(H,13,15)(H,16,17)