(E)-2-[(6-aminopurin-9-yl)oxymethyl]-4-di(propan-2-yloxy)phosphoryl-but-3-en-1-ol

Systemtic Name: (E)-2-[(6-aminopurin-9-yl)oxymethyl]-4-di(propan-2-yloxy)phosphoryl-but-3-en-1-ol Openeye Name: (E)-2-[(6-aminopurin-9-yl)oxymethyl]-4-diisopropoxyphosphoryl-but-3-en-1-ol CAS Name: (E)-2-[(6-aminopurin-9-yl)oxymethyl]-4-di(propan-2-yloxy)phosphoryl-3-buten-1-ol IUPAC Name: (E)-2-[(6-aminopurin-9-yl)oxymethyl]-4-di(propan-2-yloxy)phosphorylbut-3-en-1-ol Traditional Name: (E)-2-(adenin-9-yloxymethyl)-4-diisopropoxyphosphoryl-but-3-en-1-ol Formula: C16H26N5O5P MolecularWeight: 399.381901

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(C=CC(CO)CON1C=NC2=C1N=CN=C2N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(/C=C/C(CO)CON1C=NC2=C1N=CN=C2N)OC(C)C

InChI

InChI=1S/C16H26N5O5P/c1-11(2)25-27(23,26-12(3)4)6-5-13(7-22)8-24-21-10-20-14-15(17)18-9-19-16(14)21/h5-6,9-13,22H,7-8H2,1-4H3,(H2,17,18,19)/b6-5+