methyl (3S)-3-(5-chloranyl-6-methoxy-pyridin-3-yl)-3-[[(3R)-piperidin-3-yl]carbonylamino]propanoate

Systemtic Name: methyl (3S)-3-(5-chloranyl-6-methoxy-pyridin-3-yl)-3-[[(3R)-piperidin-3-yl]carbonylamino]propanoate Openeye Name: methyl (3S)-3-(5-chloro-6-methoxy-3-pyridyl)-3-[[(3R)-piperidine-3-carbonyl]amino]propanoate CAS Name: (3S)-3-(5-chloro-6-methoxy-3-pyridinyl)-3-[[oxo-[(3R)-3-piperidinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (3S)-3-(5-chloro-6-methoxypyridin-3-yl)-3-[[(3R)-piperidine-3-carbonyl]amino]propanoate Traditional Name: (3S)-3-(5-chloro-6-methoxy-3-pyridyl)-3-[[(3R)-nipecotoyl]amino]propionic acid methyl ester Formula: C16H22ClN3O4 MolecularWeight: 355.81658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=N1)C(CC(=O)OC)NC(=O)C2CCCNC2)Cl

Isomeric SMILES

COC1=C(C=C(C=N1)[C@H](CC(=O)OC)NC(=O)[C@@H]2CCCNC2)Cl

InChI

InChI=1S/C16H22ClN3O4/c1-23-14(21)7-13(11-6-12(17)16(24-2)19-9-11)20-15(22)10-4-3-5-18-8-10/h6,9-10,13,18H,3-5,7-8H2,1-2H3,(H,20,22)/t10-,13+/m1/s1