2-azanyl-7-[5-(hydroxymethyl)-3-methoxy-4-oxidanyl-oxolan-2-yl]-5-isocyano-1H-pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-7-[5-(hydroxymethyl)-3-methoxy-4-oxidanyl-oxolan-2-yl]-5-isocyano-1H-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-7-[4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-5-isocyano-1H-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-7-[4-hydroxy-5-(hydroxymethyl)-3-methoxy-2-oxolanyl]-5-isocyano-1H-pyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-amino-7-[4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-5-isocyano-1H-pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-7-(4-hydroxy-3-methoxy-5-methylol-tetrahydrofuran-2-yl)-5-isocyano-1H-pyrrolo[2,3-d]pyrimidin-4-one Formula: C13H15N5O5 MolecularWeight: 321.2887

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(OC1N2C=C(C3=C2NC(=NC3=O)N)[N+]#[C-])CO)O

Isomeric SMILES

COC1C(C(OC1N2C=C(C3=C2NC(=NC3=O)N)[N+]#[C-])CO)O

InChI

InChI=1S/C13H15N5O5/c1-15-5-3-18(10-7(5)11(21)17-13(14)16-10)12-9(22-2)8(20)6(4-19)23-12/h3,6,8-9,12,19-20H,4H2,2H3,(H3,14,16,17,21)