[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl pyridine-3-carboxylate

Systemtic Name: [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl pyridine-3-carboxylate Openeye Name: [5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl ester IUPAC Name: [5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl pyridine-3-carboxylate Traditional Name: nicotinic acid [5-(4-amino-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C15H16N4O6 MolecularWeight: 348.31074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OCC2C(C(C(O2)N3C=CC(=NC3=O)N)O)O

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OCC2C(C(C(O2)N3C=CC(=NC3=O)N)O)O

InChI

InChI=1S/C15H16N4O6/c16-10-3-5-19(15(23)18-10)13-12(21)11(20)9(25-13)7-24-14(22)8-2-1-4-17-6-8/h1-6,9,11-13,20-21H,7H2,(H2,16,18,23)