5-(hydroxymethyl)-3,4-bis(pyridin-3-ylcarbonyloxy)oxolan-2-olate

Systemtic Name: 5-(hydroxymethyl)-3,4-bis(pyridin-3-ylcarbonyloxy)oxolan-2-olate Openeye Name: 5-(hydroxymethyl)-3,4-bis(pyridine-3-carbonyloxy)tetrahydrofuran-2-olate CAS Name: 5-(hydroxymethyl)-3,4-bis[oxo(3-pyridinyl)methoxy]-2-oxolanolate IUPAC Name: 5-(hydroxymethyl)-3,4-bis(pyridine-3-carbonyloxy)oxolan-2-olate Traditional Name: 5-methylol-3,4-dinicotinoyloxy-tetrahydrofuran-2-olate Formula: C17H15N2O7- MolecularWeight: 359.3102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OC2C(OC(C2OC(=O)C3=CN=CC=C3)[O-])CO

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OC2C(OC(C2OC(=O)C3=CN=CC=C3)[O-])CO

InChI

InChI=1S/C17H15N2O7/c20-9-12-13(25-15(21)10-3-1-5-18-7-10)14(17(23)24-12)26-16(22)11-4-2-6-19-8-11/h1-8,12-14,17,20H,9H2/q-1