N-[2-(2,3-dimethoxyphenoxy)ethyl]-N'-pyrimidin-2-yl-propane-1,3-diamine; ethanedioic acid

Systemtic Name: N-[2-(2,3-dimethoxyphenoxy)ethyl]-N'-pyrimidin-2-yl-propane-1,3-diamine; ethanedioic acid Openeye Name: N-[2-(2,3-dimethoxyphenoxy)ethyl]-N'-pyrimidin-2-yl-propane-1,3-diamine; oxalic acid CAS Name: N-[2-(2,3-dimethoxyphenoxy)ethyl]-N'-(2-pyrimidinyl)propane-1,3-diamine; oxalic acid IUPAC Name: N-[2-(2,3-dimethoxyphenoxy)ethyl]-N'-pyrimidin-2-ylpropane-1,3-diamine; oxalic acid Traditional Name: 2-(2,3-dimethoxyphenoxy)ethyl-[3-(2-pyrimidylamino)propyl]amine; oxalic acid Formula: C19H26N4O7 MolecularWeight: 422.43234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OCCNCCCNC2=NC=CC=N2)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OCCNCCCNC2=NC=CC=N2)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H24N4O3.C2H2O4/c1-22-14-6-3-7-15(16(14)23-2)24-13-12-18-8-4-9-19-17-20-10-5-11-21-17;3-1(4)2(5)6/h3,5-7,10-11,18H,4,8-9,12-13H2,1-2H3,(H,19,20,21);(H,3,4)(H,5,6)