2-[(2-azanyl-6-phosphonooxy-7,8-dihydropurin-9-yl)methoxy]ethyl dihydrogen phosphate

Systemtic Name: 2-[(2-azanyl-6-phosphonooxy-7,8-dihydropurin-9-yl)methoxy]ethyl dihydrogen phosphate Openeye Name: 2-[(2-amino-6-phosphonooxy-7,8-dihydropurin-9-yl)methoxy]ethyl dihydrogen phosphate CAS Name: 2-[(2-amino-6-phosphonooxy-7,8-dihydropurin-9-yl)methoxy]ethyl dihydrogen phosphate IUPAC Name: 2-[(2-amino-6-phosphonooxy-7,8-dihydropurin-9-yl)methoxy]ethyl dihydrogen phosphate Traditional Name: 2-[(2-amino-6-phosphonooxy-7,8-dihydropurin-9-yl)methoxy]ethyl dihydrogen phosphate Formula: C8H15N5O9P2 MolecularWeight: 387.180322

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=C(N1COCCOP(=O)(O)O)N=C(N=C2OP(=O)(O)O)N

Isomeric SMILES

C1NC2=C(N1COCCOP(=O)(O)O)N=C(N=C2OP(=O)(O)O)N

InChI

InChI=1S/C8H15N5O9P2/c9-8-11-6-5(7(12-8)22-24(17,18)19)10-3-13(6)4-20-1-2-21-23(14,15)16/h10H,1-4H2,(H2,9,11,12)(H2,14,15,16)(H2,17,18,19)