7-(3,5-dihydro-2H-1,4-benzodioxepin-3-yl)-6-prop-2-enoxy-purine

Systemtic Name: 7-(3,5-dihydro-2H-1,4-benzodioxepin-3-yl)-6-prop-2-enoxy-purine Openeye Name: 6-allyloxy-7-(3,5-dihydro-2H-1,4-benzodioxepin-3-yl)purine CAS Name: 7-(3,5-dihydro-2H-1,4-benzodioxepin-3-yl)-6-prop-2-enoxypurine IUPAC Name: 7-(3,5-dihydro-2H-1,4-benzodioxepin-3-yl)-6-prop-2-enoxypurine Traditional Name: 6-allyloxy-7-(3,5-dihydro-2H-1,4-benzodioxepin-3-yl)purine Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=NC=NC2=C1N(C=N2)C3COC4=CC=CC=C4CO3

Isomeric SMILES

C=CCOC1=NC=NC2=C1N(C=N2)C3COC4=CC=CC=C4CO3

InChI

InChI=1S/C17H16N4O3/c1-2-7-22-17-15-16(18-10-19-17)20-11-21(15)14-9-23-13-6-4-3-5-12(13)8-24-14/h2-6,10-11,14H,1,7-9H2