tert-butyl (2S)-3-(4-nitrophenyl)-2-[[(2S)-piperidin-2-yl]carbonylamino]propanoate

Systemtic Name: tert-butyl (2S)-3-(4-nitrophenyl)-2-[[(2S)-piperidin-2-yl]carbonylamino]propanoate Openeye Name: tert-butyl (2S)-3-(4-nitrophenyl)-2-[[(2S)-piperidine-2-carbonyl]amino]propanoate CAS Name: (2S)-3-(4-nitrophenyl)-2-[[oxo-[(2S)-2-piperidinyl]methyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-3-(4-nitrophenyl)-2-[[(2S)-piperidine-2-carbonyl]amino]propanoate Traditional Name: (2S)-3-(4-nitrophenyl)-2-[[(2S)-pipecoloyl]amino]propionic acid tert-butyl ester Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2CCCCN2

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)[C@@H]2CCCCN2

InChI

InChI=1S/C19H27N3O5/c1-19(2,3)27-18(24)16(21-17(23)15-6-4-5-11-20-15)12-13-7-9-14(10-8-13)22(25)26/h7-10,15-16,20H,4-6,11-12H2,1-3H3,(H,21,23)/t15-,16-/m0/s1