methyl (2S)-3-(4-chloranylpyridin-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(4-chloranylpyridin-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-(4-chloro-3-pyridyl)propanoate CAS Name: (2S)-3-(4-chloro-3-pyridinyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-chloropyridin-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(4-chloro-3-pyridyl)propionic acid methyl ester Formula: C14H19ClN2O4 MolecularWeight: 314.76466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(C=CN=C1)Cl)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=C(C=CN=C1)Cl)C(=O)OC

InChI

InChI=1S/C14H19ClN2O4/c1-14(2,3)21-13(19)17-11(12(18)20-4)7-9-8-16-6-5-10(9)15/h5-6,8,11H,7H2,1-4H3,(H,17,19)/t11-/m0/s1