6-chloranyl-9-[[4-(diethoxyphosphorylmethyl)phenyl]methyl]purine

Systemtic Name: 6-chloranyl-9-[[4-(diethoxyphosphorylmethyl)phenyl]methyl]purine Openeye Name: 6-chloro-9-[[4-(diethoxyphosphorylmethyl)phenyl]methyl]purine CAS Name: 6-chloro-9-[[4-(diethoxyphosphorylmethyl)phenyl]methyl]purine IUPAC Name: 6-chloro-9-[[4-(diethoxyphosphorylmethyl)phenyl]methyl]purine Traditional Name: 6-chloro-9-[4-(diethoxyphosphorylmethyl)benzyl]purine Formula: C17H20ClN4O3P MolecularWeight: 394.792461

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3Cl)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3Cl)OCC

InChI

InChI=1S/C17H20ClN4O3P/c1-3-24-26(23,25-4-2)10-14-7-5-13(6-8-14)9-22-12-21-15-16(18)19-11-20-17(15)22/h5-8,11-12H,3-4,9-10H2,1-2H3