3-[[(3R)-1-(phenylsulfonyl)piperidin-3-yl]carbonylamino]propanoate

Systemtic Name: 3-[[(3R)-1-(phenylsulfonyl)piperidin-3-yl]carbonylamino]propanoate Openeye Name: 3-[[(3R)-1-(benzenesulfonyl)piperidine-3-carbonyl]amino]propanoate CAS Name: 3-[[[(3R)-1-(benzenesulfonyl)-3-piperidinyl]-oxomethyl]amino]propanoate IUPAC Name: 3-[[(3R)-1-(benzenesulfonyl)piperidine-3-carbonyl]amino]propanoate Traditional Name: 3-[[(3R)-1-besylnipecotoyl]amino]propionate Formula: C15H19N2O5S- MolecularWeight: 339.38676

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCCC(=O)[O-]

Isomeric SMILES

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NCCC(=O)[O-]

InChI

InChI=1S/C15H20N2O5S/c18-14(19)8-9-16-15(20)12-5-4-10-17(11-12)23(21,22)13-6-2-1-3-7-13/h1-3,6-7,12H,4-5,8-11H2,(H,16,20)(H,18,19)/p-1/t12-/m1/s1