diethyl (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-yl]carbonylamino]pentanedioate

Systemtic Name: diethyl (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypyridin-2-yl]carbonylamino]pentanedioate Openeye Name: diethyl (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypyridine-2-carbonyl]amino]pentanedioate CAS Name: (2S)-2-[[[3-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-2-pyridinyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypyridine-2-carbonyl]amino]pentanedioate Traditional Name: (2S)-2-[[3-(4,6-dimethoxypyrimidin-2-yl)oxypicolinoyl]amino]glutaric acid diethyl ester Formula: C21H26N4O8 MolecularWeight: 462.45314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=C(C=CC=N1)OC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=C(C=CC=N1)OC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C21H26N4O8/c1-5-31-17(26)10-9-13(20(28)32-6-2)23-19(27)18-14(8-7-11-22-18)33-21-24-15(29-3)12-16(25-21)30-4/h7-8,11-13H,5-6,9-10H2,1-4H3,(H,23,27)/t13-/m0/s1