methyl (3S)-3-(5-bromanylpyridin-3-yl)-3-[[(3R)-piperidin-3-yl]carbonylamino]propanoate

Systemtic Name: methyl (3S)-3-(5-bromanylpyridin-3-yl)-3-[[(3R)-piperidin-3-yl]carbonylamino]propanoate Openeye Name: methyl (3S)-3-(5-bromo-3-pyridyl)-3-[[(3R)-piperidine-3-carbonyl]amino]propanoate CAS Name: (3S)-3-(5-bromo-3-pyridinyl)-3-[[oxo-[(3R)-3-piperidinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (3S)-3-(5-bromopyridin-3-yl)-3-[[(3R)-piperidine-3-carbonyl]amino]propanoate Traditional Name: (3S)-3-(5-bromo-3-pyridyl)-3-[[(3R)-nipecotoyl]amino]propionic acid methyl ester Formula: C15H20BrN3O3 MolecularWeight: 370.2416

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC(=CN=C1)Br)NC(=O)C2CCCNC2

Isomeric SMILES

COC(=O)C[C@@H](C1=CC(=CN=C1)Br)NC(=O)[C@@H]2CCCNC2

InChI

InChI=1S/C15H20BrN3O3/c1-22-14(20)6-13(11-5-12(16)9-18-8-11)19-15(21)10-3-2-4-17-7-10/h5,8-10,13,17H,2-4,6-7H2,1H3,(H,19,21)/t10-,13+/m1/s1