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

Systemtic Name: 3-[(1-ethylsulfonylpiperidin-4-yl)carbonylamino]butanoic acid Openeye Name: 3-[(1-ethylsulfonylpiperidine-4-carbonyl)amino]butanoic acid CAS Name: 3-[[(1-ethylsulfonyl-4-piperidinyl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-[(1-ethylsulfonylpiperidine-4-carbonyl)amino]butanoic acid Traditional Name: 3-[(1-esylisonipecotoyl)amino]butyric acid Formula: C12H22N2O5S MolecularWeight: 306.37848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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