2-chloranyl-9-[3-diethoxyphosphoryl-2-(diethoxyphosphorylmethyl)propyl]-N-methyl-purin-6-amine

Systemtic Name: 2-chloranyl-9-[3-diethoxyphosphoryl-2-(diethoxyphosphorylmethyl)propyl]-N-methyl-purin-6-amine Openeye Name: 2-chloro-9-[3-diethoxyphosphoryl-2-(diethoxyphosphorylmethyl)propyl]-N-methyl-purin-6-amine CAS Name: 2-chloro-9-[3-diethoxyphosphoryl-2-(diethoxyphosphorylmethyl)propyl]-N-methyl-6-purinamine IUPAC Name: 2-chloro-9-[3-diethoxyphosphoryl-2-(diethoxyphosphorylmethyl)propyl]-N-methylpurin-6-amine Traditional Name: [2-chloro-9-[3-diethoxyphosphoryl-2-(diethoxyphosphorylmethyl)propyl]purin-6-yl]-methyl-amine Formula: C18H32ClN5O6P2 MolecularWeight: 511.877102

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(CN1C=NC2=C1N=C(N=C2NC)Cl)CP(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(CC(CN1C=NC2=C1N=C(N=C2NC)Cl)CP(=O)(OCC)OCC)OCC

InChI

InChI=1S/C18H32ClN5O6P2/c1-6-27-31(25,28-7-2)11-14(12-32(26,29-8-3)30-9-4)10-24-13-21-15-16(20-5)22-18(19)23-17(15)24/h13-14H,6-12H2,1-5H3,(H,20,22,23)