2-(6-aminopurin-9-yl)oxyethoxymethyl-[(4-bromophenyl)methoxy]phosphinic acid

Systemtic Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-[(4-bromophenyl)methoxy]phosphinic acid Openeye Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-[(4-bromophenyl)methoxy]phosphinic acid CAS Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-[(4-bromophenyl)methoxy]phosphinic acid IUPAC Name: 2-(6-aminopurin-9-yl)oxyethoxymethyl-[(4-bromophenyl)methoxy]phosphinic acid Traditional Name: 2-adenin-9-yloxyethoxymethyl-(4-bromobenzyl)oxy-phosphinic acid Formula: C15H17BrN5O5P MolecularWeight: 458.203741

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COP(=O)(COCCON2C=NC3=C2N=CN=C3N)O)Br

Isomeric SMILES

C1=CC(=CC=C1COP(=O)(COCCON2C=NC3=C2N=CN=C3N)O)Br

InChI

InChI=1S/C15H17BrN5O5P/c16-12-3-1-11(2-4-12)7-26-27(22,23)10-24-5-6-25-21-9-20-13-14(17)18-8-19-15(13)21/h1-4,8-9H,5-7,10H2,(H,22,23)(H2,17,18,19)