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

Systemtic Name: (E)-2-(6-aminopurin-9-yl)oxy-4-di(propan-2-yloxy)phosphoryl-but-3-en-1-ol Openeye Name: (E)-2-(6-aminopurin-9-yl)oxy-4-diisopropoxyphosphoryl-but-3-en-1-ol CAS Name: (E)-2-(6-aminopurin-9-yl)oxy-4-di(propan-2-yloxy)phosphoryl-3-buten-1-ol IUPAC Name: (E)-2-(6-aminopurin-9-yl)oxy-4-di(propan-2-yloxy)phosphorylbut-3-en-1-ol Traditional Name: (E)-2-adenin-9-yloxy-4-diisopropoxyphosphoryl-but-3-en-1-ol Formula: C15H24N5O5P MolecularWeight: 385.355321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(C=CC(CO)ON1C=NC2=C1N=CN=C2N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(/C=C/C(CO)ON1C=NC2=C1N=CN=C2N)OC(C)C

InChI

InChI=1S/C15H24N5O5P/c1-10(2)24-26(22,25-11(3)4)6-5-12(7-21)23-20-9-19-13-14(16)17-8-18-15(13)20/h5-6,8-12,21H,7H2,1-4H3,(H2,16,17,18)/b6-5+