2-[(2E)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]ethylphosphonic acid

Systemtic Name: 2-[(2E)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]ethylphosphonic acid Openeye Name: 2-[(2E)-2-[(6-aminopurin-9-yl)methylene]cyclopropyl]ethylphosphonic acid CAS Name: 2-[(2E)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]ethylphosphonic acid IUPAC Name: 2-[(2E)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]ethylphosphonic acid Traditional Name: 2-[(2E)-2-(adenin-9-ylmethylene)cyclopropyl]ethylphosphonic acid Formula: C11H14N5O3P MolecularWeight: 295.234321

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1=CN2C=NC3=C2N=CN=C3N)CCP(=O)(O)O

Isomeric SMILES

C\1C(/C1=C/N2C=NC3=C2N=CN=C3N)CCP(=O)(O)O

InChI

InChI=1S/C11H14N5O3P/c12-10-9-11(14-5-13-10)16(6-15-9)4-8-3-7(8)1-2-20(17,18)19/h4-7H,1-3H2,(H2,12,13,14)(H2,17,18,19)/b8-4+