2-(hydroxymethyl)-5-[6-[[(E)-3-phenylprop-2-enyl]amino]purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[6-[[(E)-3-phenylprop-2-enyl]amino]purin-9-yl]oxolane-3,4-diol Openeye Name: 2-[6-[[(E)-cinnamyl]amino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[6-[[(E)-3-phenylprop-2-enyl]amino]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[6-[[(E)-3-phenylprop-2-enyl]amino]purin-9-yl]oxolane-3,4-diol Traditional Name: 2-[6-[[(E)-cinnamyl]amino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O4/c25-9-13-15(26)16(27)19(28-13)24-11-23-14-17(21-10-22-18(14)24)20-8-4-7-12-5-2-1-3-6-12/h1-7,10-11,13,15-16,19,25-27H,8-9H2,(H,20,21,22)/b7-4+