9-(1,2-dioxan-4-ylmethyl)-6-phenylmethoxy-purine-2,8-diamine

Systemtic Name: 9-(1,2-dioxan-4-ylmethyl)-6-phenylmethoxy-purine-2,8-diamine Openeye Name: 6-benzyloxy-9-(dioxan-4-ylmethyl)purine-2,8-diamine CAS Name: 9-(4-dioxanylmethyl)-6-phenylmethoxypurine-2,8-diamine IUPAC Name: 9-(dioxan-4-ylmethyl)-6-phenylmethoxypurine-2,8-diamine Traditional Name: [2-amino-6-benzoxy-9-(dioxan-4-ylmethyl)purin-8-yl]amine Formula: C17H20N6O3 MolecularWeight: 356.3791

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Descriptors Computed from Structure

Canonical SMILES:

C1COOCC1CN2C3=C(C(=NC(=N3)N)OCC4=CC=CC=C4)N=C2N

Isomeric SMILES

C1COOCC1CN2C3=C(C(=NC(=N3)N)OCC4=CC=CC=C4)N=C2N

InChI

InChI=1S/C17H20N6O3/c18-16-21-14-13(15(22-16)24-9-11-4-2-1-3-5-11)20-17(19)23(14)8-12-6-7-25-26-10-12/h1-5,12H,6-10H2,(H2,19,20)(H2,18,21,22)