2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[[1-[3-(4-piperidyl)propanoyl]piperidine-3-carbonyl]amino]propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[[oxo-[1-[1-oxo-3-(4-piperidinyl)propyl]-3-piperidinyl]methyl]amino]propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[[1-(3-piperidin-4-ylpropanoyl)piperidine-3-carbonyl]amino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[[1-[3-(4-piperidyl)propanoyl]nipecotoyl]amino]propionic acid Formula: C22H38N4O6 MolecularWeight: 454.56032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CNC(=O)C1CCCN(C1)C(=O)CCC2CCNCC2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CNC(=O)C1CCCN(C1)C(=O)CCC2CCNCC2)C(=O)O

InChI

InChI=1S/C22H38N4O6/c1-22(2,3)32-21(31)25-17(20(29)30)13-24-19(28)16-5-4-12-26(14-16)18(27)7-6-15-8-10-23-11-9-15/h15-17,23H,4-14H2,1-3H3,(H,24,28)(H,25,31)(H,29,30)