2-(6-aminopurin-9-yl)oxyethoxymethyl-phenylmethoxy-phosphinic acid

Systemtic Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-phenylmethoxy-phosphinic acid Openeye Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-benzyloxy-phosphinic acid CAS Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-phenylmethoxyphosphinic acid IUPAC Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-phenylmethoxyphosphinic acid Traditional Name: 2-adenin-9-yloxyethoxymethyl(benzoxy)phosphinic acid Formula: C15H18N5O5P MolecularWeight: 379.307681

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COP(=O)(COCCON2C=NC3=C2N=CN=C3N)O

Isomeric SMILES

C1=CC=C(C=C1)COP(=O)(COCCON2C=NC3=C2N=CN=C3N)O

InChI

InChI=1S/C15H18N5O5P/c16-14-13-15(18-9-17-14)20(10-19-13)24-7-6-23-11-26(21,22)25-8-12-4-2-1-3-5-12/h1-5,9-10H,6-8,11H2,(H,21,22)(H2,16,17,18)