[(E)-3-[(6-azanyl-7H-purin-2-yl)methoxy]prop-1-enyl]phosphonic acid

Systemtic Name: [(E)-3-[(6-azanyl-7H-purin-2-yl)methoxy]prop-1-enyl]phosphonic acid Openeye Name: [(E)-3-[(6-amino-7H-purin-2-yl)methoxy]prop-1-enyl]phosphonic acid CAS Name: [(E)-3-[(6-amino-7H-purin-2-yl)methoxy]prop-1-enyl]phosphonic acid IUPAC Name: [(E)-3-[(6-amino-7H-purin-2-yl)methoxy]prop-1-enyl]phosphonic acid Traditional Name: [(E)-3-[(6-amino-7H-purin-2-yl)methoxy]prop-1-enyl]phosphonic acid Formula: C9H12N5O4P MolecularWeight: 285.196441

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC(=N2)COCC=CP(=O)(O)O)N

Isomeric SMILES

C1=NC2=C(N1)C(=NC(=N2)COC/C=C/P(=O)(O)O)N

InChI

InChI=1S/C9H12N5O4P/c10-8-7-9(12-5-11-7)14-6(13-8)4-18-2-1-3-19(15,16)17/h1,3,5H,2,4H2,(H2,15,16,17)(H3,10,11,12,13,14)/b3-1+