ethyl (E)-3-[6-azanyl-9-[(2R,3R,5S)-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]purin-8-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[6-azanyl-9-[(2R,3R,5S)-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]purin-8-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[6-amino-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-8-yl]prop-2-enoate CAS Name: (E)-3-[6-amino-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-8-purinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[6-amino-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-8-yl]prop-2-enoate Traditional Name: (E)-3-[6-amino-9-[(2R,3R,5S)-3-hydroxy-5-methylol-tetrahydrofuran-2-yl]purin-8-yl]acrylic acid ethyl ester Formula: C15H19N5O5 MolecularWeight: 349.34186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=NC2=C(N1C3C(CC(O3)CO)O)N=CN=C2N

Isomeric SMILES

CCOC(=O)/C=C/C1=NC2=C(N1[C@H]3[C@@H](C[C@H](O3)CO)O)N=CN=C2N

InChI

InChI=1S/C15H19N5O5/c1-2-24-11(23)4-3-10-19-12-13(16)17-7-18-14(12)20(10)15-9(22)5-8(6-21)25-15/h3-4,7-9,15,21-22H,2,5-6H2,1H3,(H2,16,17,18)/b4-3+/t8-,9+,15+/m0/s1