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

Systemtic Name: (E)-2-[(6-aminopurin-9-yl)methyl]-4-di(propan-2-yloxy)phosphoryl-but-3-en-1-ol Openeye Name: (E)-2-[(6-aminopurin-9-yl)methyl]-4-diisopropoxyphosphoryl-but-3-en-1-ol CAS Name: (E)-2-[(6-aminopurin-9-yl)methyl]-4-di(propan-2-yloxy)phosphoryl-3-buten-1-ol IUPAC Name: (E)-2-[(6-aminopurin-9-yl)methyl]-4-di(propan-2-yloxy)phosphorylbut-3-en-1-ol Traditional Name: (E)-2-(adenin-9-ylmethyl)-4-diisopropoxyphosphoryl-but-3-en-1-ol Formula: C16H26N5O4P MolecularWeight: 383.382501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(C=CC(CN1C=NC2=C1N=CN=C2N)CO)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(/C=C/C(CN1C=NC2=C1N=CN=C2N)CO)OC(C)C

InChI

InChI=1S/C16H26N5O4P/c1-11(2)24-26(23,25-12(3)4)6-5-13(8-22)7-21-10-20-14-15(17)18-9-19-16(14)21/h5-6,9-13,22H,7-8H2,1-4H3,(H2,17,18,19)/b6-5+