methyl (2S)-1-[2-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]carbonylazetidine-2-carboxylate

Systemtic Name: methyl (2S)-1-[2-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]carbonylazetidine-2-carboxylate Openeye Name: methyl (2S)-1-[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]azetidine-2-carboxylate CAS Name: (2S)-1-[[2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]phenyl]-oxomethyl]-2-azetidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]azetidine-2-carboxylate Traditional Name: (2S)-1-[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]azetidine-2-carboxylic acid methyl ester Formula: C18H19N3O6 MolecularWeight: 373.35996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)N3CCC3C(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)N3CC[C@H]3C(=O)OC)OC

InChI

InChI=1S/C18H19N3O6/c1-24-14-10-15(25-2)20-18(19-14)27-13-7-5-4-6-11(13)16(22)21-9-8-12(21)17(23)26-3/h4-7,10,12H,8-9H2,1-3H3/t12-/m0/s1