ditert-butyl 2-(5-ethoxycarbonylpyridin-3-yl)imino-5-[(2-methylpropan-2-yl)oxycarbonyloxy]-1,3-diazinane-1,3-dicarboxylate

Systemtic Name: ditert-butyl 2-(5-ethoxycarbonylpyridin-3-yl)imino-5-[(2-methylpropan-2-yl)oxycarbonyloxy]-1,3-diazinane-1,3-dicarboxylate Openeye Name: ditert-butyl 5-tert-butoxycarbonyloxy-2-[(5-ethoxycarbonyl-3-pyridyl)imino]hexahydropyrimidine-1,3-dicarboxylate CAS Name: 2-[(5-ethoxycarbonyl-3-pyridinyl)imino]-5-[(2-methylpropan-2-yl)oxy-oxomethoxy]-1,3-diazinane-1,3-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-(5-ethoxycarbonylpyridin-3-yl)imino-5-[(2-methylpropan-2-yl)oxycarbonyloxy]-1,3-diazinane-1,3-dicarboxylate Traditional Name: 5-tert-butoxycarbonyloxy-2-[(5-carbethoxy-3-pyridyl)imino]hexahydropyrimidine-1,3-dicarboxylic acid ditert-butyl ester Formula: C27H40N4O9 MolecularWeight: 564.6279

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN=C1)N=C2N(CC(CN2C(=O)OC(C)(C)C)OC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CN=C1)N=C2N(CC(CN2C(=O)OC(C)(C)C)OC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H40N4O9/c1-11-36-20(32)17-12-18(14-28-13-17)29-21-30(22(33)38-25(2,3)4)15-19(37-24(35)40-27(8,9)10)16-31(21)23(34)39-26(5,6)7/h12-14,19H,11,15-16H2,1-10H3