[4-[3-(6-aminopurin-9-yl)propoxy]-3-fluoranyl-phenyl]methylphosphonic acid

Systemtic Name: [4-[3-(6-aminopurin-9-yl)propoxy]-3-fluoranyl-phenyl]methylphosphonic acid Openeye Name: [4-[3-(6-aminopurin-9-yl)propoxy]-3-fluoro-phenyl]methylphosphonic acid CAS Name: [4-[3-(6-aminopurin-9-yl)propoxy]-3-fluorophenyl]methylphosphonic acid IUPAC Name: [4-[3-(6-aminopurin-9-yl)propoxy]-3-fluorophenyl]methylphosphonic acid Traditional Name: [4-(3-adenin-9-ylpropoxy)-3-fluoro-benzyl]phosphonic acid Formula: C15H17FN5O4P MolecularWeight: 381.298744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CP(=O)(O)O)F)OCCCN2C=NC3=C2N=CN=C3N

Isomeric SMILES

C1=CC(=C(C=C1CP(=O)(O)O)F)OCCCN2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C15H17FN5O4P/c16-11-6-10(7-26(22,23)24)2-3-12(11)25-5-1-4-21-9-20-13-14(17)18-8-19-15(13)21/h2-3,6,8-9H,1,4-5,7H2,(H2,17,18,19)(H2,22,23,24)