2-(6-aminopurin-9-yl)oxyethoxymethyl-(4-methoxyphenoxy)phosphinic acid

Systemtic Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-(4-methoxyphenoxy)phosphinic acid Openeye Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-(4-methoxyphenoxy)phosphinic acid CAS Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-(4-methoxyphenoxy)phosphinic acid IUPAC Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-(4-methoxyphenoxy)phosphinic acid Traditional Name: 2-adenin-9-yloxyethoxymethyl-(4-methoxyphenoxy)phosphinic acid Formula: C15H18N5O6P MolecularWeight: 395.307081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OP(=O)(COCCON2C=NC3=C2N=CN=C3N)O

Isomeric SMILES

COC1=CC=C(C=C1)OP(=O)(COCCON2C=NC3=C2N=CN=C3N)O

InChI

InChI=1S/C15H18N5O6P/c1-23-11-2-4-12(5-3-11)26-27(21,22)10-24-6-7-25-20-9-19-13-14(16)17-8-18-15(13)20/h2-5,8-9H,6-7,10H2,1H3,(H,21,22)(H2,16,17,18)