4-azanylidene-1-[3,4-bis(oxidanyl)-5-(phosphonooxymethyl)oxolan-2-yl]pyridine-3-carboxylic acid

Systemtic Name: 4-azanylidene-1-[3,4-bis(oxidanyl)-5-(phosphonooxymethyl)oxolan-2-yl]pyridine-3-carboxylic acid Openeye Name: 1-[3,4-dihydroxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]-4-imino-pyridine-3-carboxylic acid CAS Name: 1-[3,4-dihydroxy-5-(phosphonooxymethyl)-2-oxolanyl]-4-imino-3-pyridinecarboxylic acid IUPAC Name: 1-[3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]-4-iminopyridine-3-carboxylic acid Traditional Name: 1-[3,4-dihydroxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]-4-imino-nicotinic acid Formula: C11H15N2O9P MolecularWeight: 350.218561

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C(C1=N)C(=O)O)C2C(C(C(O2)COP(=O)(O)O)O)O

Isomeric SMILES

C1=CN(C=C(C1=N)C(=O)O)C2C(C(C(O2)COP(=O)(O)O)O)O

InChI

InChI=1S/C11H15N2O9P/c12-6-1-2-13(3-5(6)11(16)17)10-9(15)8(14)7(22-10)4-21-23(18,19)20/h1-3,7-10,12,14-15H,4H2,(H,16,17)(H2,18,19,20)