7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-6-phenylmethoxy-purin-2-amine

Systemtic Name: 7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-6-phenylmethoxy-purin-2-amine Openeye Name: 6-benzyloxy-7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-amine CAS Name: 7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-6-phenylmethoxy-2-purinamine IUPAC Name: 7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-6-phenylmethoxypurin-2-amine Traditional Name: [6-benzoxy-7-[2-(2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-yl]amine Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)CCN2C=NC3=C2C(=NC(=N3)N)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1(OCC(CO1)CCN2C=NC3=C2C(=NC(=N3)N)OCC4=CC=CC=C4)C

InChI

InChI=1S/C20H25N5O3/c1-20(2)27-11-15(12-28-20)8-9-25-13-22-17-16(25)18(24-19(21)23-17)26-10-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H2,21,23,24)