2-[[2-azanyl-6-(cyclopropylamino)purin-9-yl]methyl]prop-2-enoxymethylphosphonic acid

Systemtic Name: 2-[[2-azanyl-6-(cyclopropylamino)purin-9-yl]methyl]prop-2-enoxymethylphosphonic acid Openeye Name: 2-[[2-amino-6-(cyclopropylamino)purin-9-yl]methyl]allyloxymethylphosphonic acid CAS Name: 2-[[2-amino-6-(cyclopropylamino)-9-purinyl]methyl]prop-2-enoxymethylphosphonic acid IUPAC Name: 2-[[2-amino-6-(cyclopropylamino)purin-9-yl]methyl]prop-2-enoxymethylphosphonic acid Traditional Name: 2-[[2-amino-6-(cyclopropylamino)purin-9-yl]methyl]allyloxymethylphosphonic acid Formula: C13H19N6O4P MolecularWeight: 354.301521

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1C=NC2=C1N=C(N=C2NC3CC3)N)COCP(=O)(O)O

Isomeric SMILES

C=C(CN1C=NC2=C1N=C(N=C2NC3CC3)N)COCP(=O)(O)O

InChI

InChI=1S/C13H19N6O4P/c1-8(5-23-7-24(20,21)22)4-19-6-15-10-11(16-9-2-3-9)17-13(14)18-12(10)19/h6,9H,1-5,7H2,(H2,20,21,22)(H3,14,16,17,18)