[3-(6-aminopurin-9-yl)-4-azanyl-butoxy]methylphosphonic acid

Systemtic Name: [3-(6-aminopurin-9-yl)-4-azanyl-butoxy]methylphosphonic acid Openeye Name: [4-amino-3-(6-aminopurin-9-yl)butoxy]methylphosphonic acid CAS Name: [4-amino-3-(6-aminopurin-9-yl)butoxy]methylphosphonic acid IUPAC Name: [4-amino-3-(6-aminopurin-9-yl)butoxy]methylphosphonic acid Traditional Name: (3-adenin-9-yl-4-amino-butoxy)methylphosphonic acid Formula: C10H17N6O4P MolecularWeight: 316.253541

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C(CCOCP(=O)(O)O)CN

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C(CCOCP(=O)(O)O)CN

InChI

InChI=1S/C10H17N6O4P/c11-3-7(1-2-20-6-21(17,18)19)16-5-15-8-9(12)13-4-14-10(8)16/h4-5,7H,1-3,6,11H2,(H2,12,13,14)(H2,17,18,19)