(2R,3R,4S,5R)-2-[6-[(4-ethoxyphenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: (2R,3R,4S,5R)-2-[6-[(4-ethoxyphenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: (2R,3R,4S,5R)-2-[6-[(4-ethoxyphenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: (2R,3R,4S,5R)-2-[6-[(4-ethoxyphenyl)methylamino]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: (2R,3R,4S,5R)-2-[6-[(4-ethoxyphenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: (2R,3R,4S,5R)-2-[6-[(4-ethoxybenzyl)amino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C19H23N5O5 MolecularWeight: 401.41642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O

InChI

InChI=1S/C19H23N5O5/c1-2-28-12-5-3-11(4-6-12)7-20-17-14-18(22-9-21-17)24(10-23-14)19-16(27)15(26)13(8-25)29-19/h3-6,9-10,13,15-16,19,25-27H,2,7-8H2,1H3,(H,20,21,22)/t13-,15-,16-,19-/m1/s1