[1-[(2-azanyl-6-butyl-purin-9-yl)methyl]cyclopropyl]oxymethylphosphonic acid

Systemtic Name: [1-[(2-azanyl-6-butyl-purin-9-yl)methyl]cyclopropyl]oxymethylphosphonic acid Openeye Name: [1-[(2-amino-6-butyl-purin-9-yl)methyl]cyclopropoxy]methylphosphonic acid CAS Name: [1-[(2-amino-6-butyl-9-purinyl)methyl]cyclopropyl]oxymethylphosphonic acid IUPAC Name: [1-[(2-amino-6-butylpurin-9-yl)methyl]cyclopropyl]oxymethylphosphonic acid Traditional Name: [1-[(2-amino-6-butyl-purin-9-yl)methyl]cyclopropoxy]methylphosphonic acid Formula: C14H22N5O4P MolecularWeight: 355.329341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=NC(=N1)N)N(C=N2)CC3(CC3)OCP(=O)(O)O

Isomeric SMILES

CCCCC1=C2C(=NC(=N1)N)N(C=N2)CC3(CC3)OCP(=O)(O)O

InChI

InChI=1S/C14H22N5O4P/c1-2-3-4-10-11-12(18-13(15)17-10)19(8-16-11)7-14(5-6-14)23-9-24(20,21)22/h8H,2-7,9H2,1H3,(H2,15,17,18)(H2,20,21,22)