3-ethanoyl-1-(hydroxymethyl)-2-(3-nitrophenyl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 3-ethanoyl-1-(hydroxymethyl)-2-(3-nitrophenyl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 3-acetyl-4-hydroxy-1-(hydroxymethyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one CAS Name: 3-acetyl-4-hydroxy-1-(hydroxymethyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one IUPAC Name: 3-acetyl-4-hydroxy-1-(hydroxymethyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one Traditional Name: 4-acetyl-3-hydroxy-1-methylol-5-(3-nitrophenyl)-3-pyrrolin-2-one Formula: C13H12N2O6 MolecularWeight: 292.24418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC(=CC=C2)[N+](=O)[O-])CO)O

Isomeric SMILES

CC(=O)C1=C(C(=O)N(C1C2=CC(=CC=C2)[N+](=O)[O-])CO)O

InChI

InChI=1S/C13H12N2O6/c1-7(17)10-11(14(6-16)13(19)12(10)18)8-3-2-4-9(5-8)15(20)21/h2-5,11,16,18H,6H2,1H3