6-[[(3R)-1-(phenylsulfonyl)piperidin-3-yl]carbonylamino]hexanoate

Systemtic Name: 6-[[(3R)-1-(phenylsulfonyl)piperidin-3-yl]carbonylamino]hexanoate Openeye Name: 6-[[(3R)-1-(benzenesulfonyl)piperidine-3-carbonyl]amino]hexanoate CAS Name: 6-[[[(3R)-1-(benzenesulfonyl)-3-piperidinyl]-oxomethyl]amino]hexanoate IUPAC Name: 6-[[(3R)-1-(benzenesulfonyl)piperidine-3-carbonyl]amino]hexanoate Traditional Name: 6-[[(3R)-1-besylnipecotoyl]amino]hexanoate Formula: C18H25N2O5S- MolecularWeight: 381.4665

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O5S/c21-17(22)11-5-2-6-12-19-18(23)15-8-7-13-20(14-15)26(24,25)16-9-3-1-4-10-16/h1,3-4,9-10,15H,2,5-8,11-14H2,(H,19,23)(H,21,22)/p-1/t15-/m1/s1