6-(2,3-dihydro-1,4-benzodioxin-5-yloxy)-N1-pyrimidin-2-yl-hexane-1,3-diamine; ethanedioic acid

Systemtic Name: 6-(2,3-dihydro-1,4-benzodioxin-5-yloxy)-N1-pyrimidin-2-yl-hexane-1,3-diamine; ethanedioic acid Openeye Name: 6-(2,3-dihydro-1,4-benzodioxin-5-yloxy)-N1-pyrimidin-2-yl-hexane-1,3-diamine; oxalic acid CAS Name: 6-(2,3-dihydro-1,4-benzodioxin-5-yloxy)-N1-(2-pyrimidinyl)hexane-1,3-diamine; oxalic acid IUPAC Name: 6-(2,3-dihydro-1,4-benzodioxin-5-yloxy)-1-N-pyrimidin-2-ylhexane-1,3-diamine; oxalic acid Traditional Name: [3-amino-6-(2,3-dihydro-1,4-benzodioxin-5-yloxy)hexyl]-(2-pyrimidyl)amine; oxalic acid Formula: C20H26N4O7 MolecularWeight: 434.44304

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC=C2OCCCC(CCNC3=NC=CC=N3)N.C(=O)(C(=O)O)O

Isomeric SMILES

C1COC2=C(O1)C=CC=C2OCCCC(CCNC3=NC=CC=N3)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H24N4O3.C2H2O4/c19-14(7-10-22-18-20-8-3-9-21-18)4-2-11-23-15-5-1-6-16-17(15)25-13-12-24-16;3-1(4)2(5)6/h1,3,5-6,8-9,14H,2,4,7,10-13,19H2,(H,20,21,22);(H,3,4)(H,5,6)