3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]-2-(propylsulfonylamino)propanoic acid

Systemtic Name: 3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]-2-(propylsulfonylamino)propanoic acid Openeye Name: 3-[3-[3-(4-piperidyl)propanoylamino]propanoylamino]-2-(propylsulfonylamino)propanoic acid CAS Name: 3-[[1-oxo-3-[[1-oxo-3-(4-piperidinyl)propyl]amino]propyl]amino]-2-(propylsulfonylamino)propanoic acid IUPAC Name: 3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]-2-(propylsulfonylamino)propanoic acid Traditional Name: 3-[3-[3-(4-piperidyl)propanoylamino]propanoylamino]-2-(propylsulfonylamino)propionic acid Formula: C17H32N4O6S MolecularWeight: 420.52418

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC(CNC(=O)CCNC(=O)CCC1CCNCC1)C(=O)O

Isomeric SMILES

CCCS(=O)(=O)NC(CNC(=O)CCNC(=O)CCC1CCNCC1)C(=O)O

InChI

InChI=1S/C17H32N4O6S/c1-2-11-28(26,27)21-14(17(24)25)12-20-16(23)7-10-19-15(22)4-3-13-5-8-18-9-6-13/h13-14,18,21H,2-12H2,1H3,(H,19,22)(H,20,23)(H,24,25)