N-[6-chloranyl-9-[3-(diethoxyphosphorylmethoxy)propoxy]purin-2-yl]methanamide

Systemtic Name: N-[6-chloranyl-9-[3-(diethoxyphosphorylmethoxy)propoxy]purin-2-yl]methanamide Openeye Name: N-[6-chloro-9-[3-(diethoxyphosphorylmethoxy)propoxy]purin-2-yl]formamide CAS Name: N-[6-chloro-9-[3-(diethoxyphosphorylmethoxy)propoxy]-2-purinyl]formamide IUPAC Name: N-[6-chloro-9-[3-(diethoxyphosphorylmethoxy)propoxy]purin-2-yl]formamide Traditional Name: N-[6-chloro-9-[3-(diethoxyphosphorylmethoxy)propoxy]purin-2-yl]formamide Formula: C14H21ClN5O6P MolecularWeight: 421.773201

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COCCCON1C=NC2=C1N=C(N=C2Cl)NC=O)OCC

Isomeric SMILES

CCOP(=O)(COCCCON1C=NC2=C1N=C(N=C2Cl)NC=O)OCC

InChI

InChI=1S/C14H21ClN5O6P/c1-3-25-27(22,26-4-2)10-23-6-5-7-24-20-8-16-11-12(15)18-14(17-9-21)19-13(11)20/h8-9H,3-7,10H2,1-2H3,(H,17,18,19,21)