ethanedioic acid; 1-(propan-2-ylamino)-3-(5-prop-2-enoxypyrimidin-2-yl)oxy-propan-2-ol

Systemtic Name: ethanedioic acid; 1-(propan-2-ylamino)-3-(5-prop-2-enoxypyrimidin-2-yl)oxy-propan-2-ol Openeye Name: 1-(5-allyloxypyrimidin-2-yl)oxy-3-(isopropylamino)propan-2-ol; oxalic acid CAS Name: oxalic acid; 1-(propan-2-ylamino)-3-[(5-prop-2-enoxy-2-pyrimidinyl)oxy]-2-propanol IUPAC Name: oxalic acid; 1-(propan-2-ylamino)-3-(5-prop-2-enoxypyrimidin-2-yl)oxypropan-2-ol Traditional Name: 1-(5-allyloxypyrimidin-2-yl)oxy-3-(isopropylamino)propan-2-ol; oxalic acid Formula: C15H23N3O7 MolecularWeight: 357.35902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=NC=C(C=N1)OCC=C)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)NCC(COC1=NC=C(C=N1)OCC=C)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H21N3O3.C2H2O4/c1-4-5-18-12-7-15-13(16-8-12)19-9-11(17)6-14-10(2)3;3-1(4)2(5)6/h4,7-8,10-11,14,17H,1,5-6,9H2,2-3H3;(H,3,4)(H,5,6)