2-[6-[azaniumylidene(azanyl)methyl]purin-9-yl]ethoxymethyl-oxidanyl-phosphinate

Systemtic Name: 2-[6-[azaniumylidene(azanyl)methyl]purin-9-yl]ethoxymethyl-oxidanyl-phosphinate Openeye Name: 2-[6-[amino(azaniumylidene)methyl]purin-9-yl]ethoxymethyl-hydroxy-phosphinate CAS Name: 2-[6-[amino(iminio)methyl]-9-purinyl]ethoxymethyl-hydroxyphosphinate IUPAC Name: 2-[6-[amino(azaniumylidene)methyl]purin-9-yl]ethoxymethyl-hydroxyphosphinate Traditional Name: 2-[6-[amino(iminio)methyl]purin-9-yl]ethoxymethyl-hydroxy-phosphinate Formula: C9H13N6O4P MolecularWeight: 300.211081

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)[O-])C(=[NH2+])N

Isomeric SMILES

C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)[O-])C(=[NH2+])N

InChI

InChI=1S/C9H13N6O4P/c10-8(11)6-7-9(13-3-12-6)15(4-14-7)1-2-19-5-20(16,17)18/h3-4H,1-2,5H2,(H3,10,11)(H2,16,17,18)