1-(2-hydroxyethyl)-3-methyl-2-(4-nitrophenyl)-5,6-bis(oxidanyl)pyridin-4-one hydrochloride

Systemtic Name: 1-(2-hydroxyethyl)-3-methyl-2-(4-nitrophenyl)-5,6-bis(oxidanyl)pyridin-4-one hydrochloride Openeye Name: 2,3-dihydroxy-1-(2-hydroxyethyl)-5-methyl-6-(4-nitrophenyl)pyridin-4-one hydrochloride CAS Name: 2,3-dihydroxy-1-(2-hydroxyethyl)-5-methyl-6-(4-nitrophenyl)-4-pyridinone hydrochloride IUPAC Name: 2,3-dihydroxy-1-(2-hydroxyethyl)-5-methyl-6-(4-nitrophenyl)pyridin-4-one hydrochloride Traditional Name: 2,3-dihydroxy-1-(2-hydroxyethyl)-5-methyl-6-(4-nitrophenyl)-4-pyridone hydrochloride Formula: C14H15ClN2O6 MolecularWeight: 342.7317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C(C1=O)O)O)CCO)C2=CC=C(C=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=C(N(C(=C(C1=O)O)O)CCO)C2=CC=C(C=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C14H14N2O6.ClH/c1-8-11(9-2-4-10(5-3-9)16(21)22)15(6-7-17)14(20)13(19)12(8)18;/h2-5,17,19-20H,6-7H2,1H3;1H