2-(naphthalen-1-ylsulfonylamino)-3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]propanoic acid

Systemtic Name: 2-(naphthalen-1-ylsulfonylamino)-3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]propanoic acid Openeye Name: 2-(1-naphthylsulfonylamino)-3-[3-[3-(4-piperidyl)propanoylamino]propanoylamino]propanoic acid CAS Name: 2-(1-naphthalenylsulfonylamino)-3-[[1-oxo-3-[[1-oxo-3-(4-piperidinyl)propyl]amino]propyl]amino]propanoic acid IUPAC Name: 2-(naphthalen-1-ylsulfonylamino)-3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]propanoic acid Traditional Name: 2-(1-naphthylsulfonylamino)-3-[3-[3-(4-piperidyl)propanoylamino]propanoylamino]propionic acid Formula: C24H32N4O6S MolecularWeight: 504.59908

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCC(=O)NCCC(=O)NCC(C(=O)O)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

C1CNCCC1CCC(=O)NCCC(=O)NCC(C(=O)O)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C24H32N4O6S/c29-22(9-8-17-10-13-25-14-11-17)26-15-12-23(30)27-16-20(24(31)32)28-35(33,34)21-7-3-5-18-4-1-2-6-19(18)21/h1-7,17,20,25,28H,8-16H2,(H,26,29)(H,27,30)(H,31,32)