N2,N6-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-7H-purine-2,6-diamine

Systemtic Name: N2,N6-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-7H-purine-2,6-diamine Openeye Name: N2,N6-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-7H-purine-2,6-diamine CAS Name: N2,N6-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-7H-purine-2,6-diamine IUPAC Name: 2-N,6-N-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-7H-purine-2,6-diamine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-7H-purin-6-yl]amine Formula: C21H18N6O4 MolecularWeight: 418.40542

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC4=C3NC=N4)NC5=CC6=C(C=C5)OCCO6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC4=C3NC=N4)NC5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C21H18N6O4/c1-3-14-16(30-7-5-28-14)9-12(1)24-20-18-19(23-11-22-18)26-21(27-20)25-13-2-4-15-17(10-13)31-8-6-29-15/h1-4,9-11H,5-8H2,(H3,22,23,24,25,26,27)