methyl (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]carbonylamino]pent-4-enoate

Systemtic Name: methyl (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]carbonylamino]pent-4-enoate Openeye Name: methyl (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]pent-4-enoate CAS Name: (2S)-2-[[[2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]phenyl]-oxomethyl]amino]-4-pentenoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]pent-4-enoate Traditional Name: (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]pent-4-enoic acid methyl ester Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)NC(CC=C)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)N[C@@H](CC=C)C(=O)OC)OC

InChI

InChI=1S/C19H21N3O6/c1-5-8-13(18(24)27-4)20-17(23)12-9-6-7-10-14(12)28-19-21-15(25-2)11-16(22-19)26-3/h5-7,9-11,13H,1,8H2,2-4H3,(H,20,23)/t13-/m0/s1