2-[(1-methylsulfonylpiperidin-3-yl)carbonylamino]butanoic acid

Systemtic Name: 2-[(1-methylsulfonylpiperidin-3-yl)carbonylamino]butanoic acid Openeye Name: 2-[(1-methylsulfonylpiperidine-3-carbonyl)amino]butanoic acid CAS Name: 2-[[(1-methylsulfonyl-3-piperidinyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(1-methylsulfonylpiperidine-3-carbonyl)amino]butanoic acid Traditional Name: 2-[(1-mesylnipecotoyl)amino]butyric acid Formula: C11H20N2O5S MolecularWeight: 292.3519

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1CCCN(C1)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1CCCN(C1)S(=O)(=O)C

InChI

InChI=1S/C11H20N2O5S/c1-3-9(11(15)16)12-10(14)8-5-4-6-13(7-8)19(2,17)18/h8-9H,3-7H2,1-2H3,(H,12,14)(H,15,16)