[2-[(6-aminopurin-9-yl)methyl]aziridin-1-yl]methylphosphonic acid

Systemtic Name: [2-[(6-aminopurin-9-yl)methyl]aziridin-1-yl]methylphosphonic acid Openeye Name: [2-[(6-aminopurin-9-yl)methyl]aziridin-1-yl]methylphosphonic acid CAS Name: [2-[(6-aminopurin-9-yl)methyl]-1-aziridinyl]methylphosphonic acid IUPAC Name: [2-[(6-aminopurin-9-yl)methyl]aziridin-1-yl]methylphosphonic acid Traditional Name: [2-(adenin-9-ylmethyl)ethylenimin-1-yl]methylphosphonic acid Formula: C9H13N6O3P MolecularWeight: 284.211681

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1CP(=O)(O)O)CN2C=NC3=C2N=CN=C3N

Isomeric SMILES

C1C(N1CP(=O)(O)O)CN2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C9H13N6O3P/c10-8-7-9(12-3-11-8)14(4-13-7)1-6-2-15(6)5-19(16,17)18/h3-4,6H,1-2,5H2,(H2,10,11,12)(H2,16,17,18)