(E)-3-[4-azanyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-pyrimidin-5-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-azanyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-pyrimidin-5-yl]prop-2-enoic acid Openeye Name: (E)-3-[4-amino-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-5-yl]prop-2-enoic acid CAS Name: (E)-3-[4-amino-1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-oxo-5-pyrimidinyl]-2-propenoic acid IUPAC Name: (E)-3-[4-amino-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-5-yl]prop-2-enoic acid Traditional Name: (E)-3-[4-amino-1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-2-keto-pyrimidin-5-yl]acrylic acid Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=C(C(=NC2=O)N)C=CC(=O)O)CO)O

Isomeric SMILES

C1C(C(OC1N2C=C(C(=NC2=O)N)/C=C/C(=O)O)CO)O

InChI

InChI=1S/C12H15N3O6/c13-11-6(1-2-10(18)19)4-15(12(20)14-11)9-3-7(17)8(5-16)21-9/h1-2,4,7-9,16-17H,3,5H2,(H,18,19)(H2,13,14,20)/b2-1+