methyl 3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl 3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-3-(2,4-dioxopyrimidin-1-yl)propanoate CAS Name: 3-(2,4-dioxo-1-pyrimidinyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(2,4-dioxopyrimidin-1-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(2,4-diketopyrimidin-1-yl)propionic acid methyl ester Formula: C13H19N3O6 MolecularWeight: 313.30646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CN1C=CC(=O)NC1=O)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CN1C=CC(=O)NC1=O)C(=O)OC

InChI

InChI=1S/C13H19N3O6/c1-13(2,3)22-12(20)14-8(10(18)21-4)7-16-6-5-9(17)15-11(16)19/h5-6,8H,7H2,1-4H3,(H,14,20)(H,15,17,19)