[3-(2-azanylpurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl phenethyl hydrogen phosphate

Systemtic Name: [3-(2-azanylpurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl phenethyl hydrogen phosphate Openeye Name: [3-(2-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl phenethyl hydrogen phosphate CAS Name: [3-(2-amino-9-purinyl)-2-(hydroxymethyl)cyclobutyl]methyl phenethyl hydrogen phosphate IUPAC Name: [3-(2-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl phenethyl hydrogen phosphate Traditional Name: [3-(2-aminopurin-9-yl)-2-methylol-cyclobutyl]methyl phenethyl hydrogen phosphate Formula: C19H24N5O5P MolecularWeight: 433.398121

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C1N2C=NC3=CN=C(N=C32)N)CO)COP(=O)(O)OCCC4=CC=CC=C4

Isomeric SMILES

C1C(C(C1N2C=NC3=CN=C(N=C32)N)CO)COP(=O)(O)OCCC4=CC=CC=C4

InChI

InChI=1S/C19H24N5O5P/c20-19-21-9-16-18(23-19)24(12-22-16)17-8-14(15(17)10-25)11-29-30(26,27)28-7-6-13-4-2-1-3-5-13/h1-5,9,12,14-15,17,25H,6-8,10-11H2,(H,26,27)(H2,20,21,23)