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

Systemtic Name: 1-(2-hydroxyethyl)-2-[(4-nitrophenyl)-oxidanyl-methyl]-3-phenylmethoxy-pyridin-4-one Openeye Name: 3-benzyloxy-1-(2-hydroxyethyl)-2-[hydroxy-(4-nitrophenyl)methyl]pyridin-4-one CAS Name: 1-(2-hydroxyethyl)-2-[hydroxy-(4-nitrophenyl)methyl]-3-phenylmethoxy-4-pyridinone IUPAC Name: 1-(2-hydroxyethyl)-2-[hydroxy-(4-nitrophenyl)methyl]-3-phenylmethoxypyridin-4-one Traditional Name: 3-benzoxy-1-(2-hydroxyethyl)-2-[hydroxy-(4-nitrophenyl)methyl]-4-pyridone Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(N(C=CC2=O)CCO)C(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(N(C=CC2=O)CCO)C(C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C21H20N2O6/c24-13-12-22-11-10-18(25)21(29-14-15-4-2-1-3-5-15)19(22)20(26)16-6-8-17(9-7-16)23(27)28/h1-11,20,24,26H,12-14H2