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

Systemtic Name: [(2E)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]methylphosphonic acid Openeye Name: [(2E)-2-[(6-aminopurin-9-yl)methylene]cyclopropyl]methylphosphonic acid CAS Name: [(2E)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]methylphosphonic acid IUPAC Name: [(2E)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]methylphosphonic acid Traditional Name: [(2E)-2-(adenin-9-ylmethylene)cyclopropyl]methylphosphonic acid Formula: C10H12N5O3P MolecularWeight: 281.207741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N5O3P/c11-9-8-10(13-4-12-9)15(5-14-8)2-6-1-7(6)3-19(16,17)18/h2,4-5,7H,1,3H2,(H2,11,12,13)(H2,16,17,18)/b6-2+