1-(2-hydroxyethyl)-2-[(4-nitrophenyl)-oxidanyl-methyl]-3-oxidanyl-pyridin-4-one hydrochloride

Systemtic Name: 1-(2-hydroxyethyl)-2-[(4-nitrophenyl)-oxidanyl-methyl]-3-oxidanyl-pyridin-4-one hydrochloride Openeye Name: 3-hydroxy-1-(2-hydroxyethyl)-2-[hydroxy-(4-nitrophenyl)methyl]pyridin-4-one hydrochloride CAS Name: 3-hydroxy-1-(2-hydroxyethyl)-2-[hydroxy-(4-nitrophenyl)methyl]-4-pyridinone hydrochloride IUPAC Name: 3-hydroxy-1-(2-hydroxyethyl)-2-[hydroxy-(4-nitrophenyl)methyl]pyridin-4-one hydrochloride Traditional Name: 3-hydroxy-1-(2-hydroxyethyl)-2-[hydroxy-(4-nitrophenyl)methyl]-4-pyridone hydrochloride Formula: C14H15ClN2O6 MolecularWeight: 342.7317

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=C(C(=O)C=CN2CCO)O)O)[N+](=O)[O-].Cl

Isomeric SMILES

C1=CC(=CC=C1C(C2=C(C(=O)C=CN2CCO)O)O)[N+](=O)[O-].Cl

InChI

InChI=1S/C14H14N2O6.ClH/c17-8-7-15-6-5-11(18)14(20)12(15)13(19)9-1-3-10(4-2-9)16(21)22;/h1-6,13,17,19-20H,7-8H2;1H