(E)-2-[(6-azanyl-7H-purin-2-yl)methoxy]-4-diethoxyphosphoryl-but-3-en-1-ol

Systemtic Name: (E)-2-[(6-azanyl-7H-purin-2-yl)methoxy]-4-diethoxyphosphoryl-but-3-en-1-ol Openeye Name: (E)-2-[(6-amino-7H-purin-2-yl)methoxy]-4-diethoxyphosphoryl-but-3-en-1-ol CAS Name: (E)-2-[(6-amino-7H-purin-2-yl)methoxy]-4-diethoxyphosphoryl-3-buten-1-ol IUPAC Name: (E)-2-[(6-amino-7H-purin-2-yl)methoxy]-4-diethoxyphosphorylbut-3-en-1-ol Traditional Name: (E)-2-[(6-amino-7H-purin-2-yl)methoxy]-4-diethoxyphosphoryl-but-3-en-1-ol Formula: C14H22N5O5P MolecularWeight: 371.328741

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C=CC(CO)OCC1=NC2=C(C(=N1)N)NC=N2)OCC

Isomeric SMILES

CCOP(=O)(/C=C/C(CO)OCC1=NC2=C(C(=N1)N)NC=N2)OCC

InChI

InChI=1S/C14H22N5O5P/c1-3-23-25(21,24-4-2)6-5-10(7-20)22-8-11-18-13(15)12-14(19-11)17-9-16-12/h5-6,9-10,20H,3-4,7-8H2,1-2H3,(H3,15,16,17,18,19)/b6-5+