2-[3-(dimethoxyphosphorylmethoxy)-2-phenylselanyl-oxolan-2-yl]-7H-purin-6-amine

Systemtic Name: 2-[3-(dimethoxyphosphorylmethoxy)-2-phenylselanyl-oxolan-2-yl]-7H-purin-6-amine Openeye Name: 2-[3-(dimethoxyphosphorylmethoxy)-2-phenylselanyl-tetrahydrofuran-2-yl]-7H-purin-6-amine CAS Name: 2-[3-(dimethoxyphosphorylmethoxy)-2-(phenylseleno)-2-oxolanyl]-7H-purin-6-amine IUPAC Name: 2-[3-(dimethoxyphosphorylmethoxy)-2-phenylselanyloxolan-2-yl]-7H-purin-6-amine Traditional Name: [2-[3-(dimethoxyphosphorylmethoxy)-2-(phenylseleno)tetrahydrofuran-2-yl]-7H-purin-6-yl]amine Formula: C18H22N5O5PSe MolecularWeight: 498.331541

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(COC1CCOC1(C2=NC3=C(C(=N2)N)NC=N3)[Se]C4=CC=CC=C4)OC

Isomeric SMILES

COP(=O)(COC1CCOC1(C2=NC3=C(C(=N2)N)NC=N3)[Se]C4=CC=CC=C4)OC

InChI

InChI=1S/C18H22N5O5PSe/c1-25-29(24,26-2)11-27-13-8-9-28-18(13,30-12-6-4-3-5-7-12)17-22-15(19)14-16(23-17)21-10-20-14/h3-7,10,13H,8-9,11H2,1-2H3,(H3,19,20,21,22,23)