3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]propylphosphonic acid

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]propylphosphonic acid Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)propylphosphonic acid CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)propylphosphonic acid IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)propylphosphonic acid Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)propylphosphonic acid Formula: C10H15N4O5P MolecularWeight: 302.223661

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCP(=O)(O)O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCP(=O)(O)O

InChI

InChI=1S/C10H15N4O5P/c1-12-8-7(9(15)13(2)10(12)16)14(6-11-8)4-3-5-20(17,18)19/h6H,3-5H2,1-2H3,(H2,17,18,19)