3-(3-nitrophenyl)-4-oxidanyl-pentan-2-one

Systemtic Name: 3-(3-nitrophenyl)-4-oxidanyl-pentan-2-one Openeye Name: 4-hydroxy-3-(3-nitrophenyl)pentan-2-one CAS Name: 4-hydroxy-3-(3-nitrophenyl)-2-pentanone IUPAC Name: 4-hydroxy-3-(3-nitrophenyl)pentan-2-one Traditional Name: 4-hydroxy-3-(3-nitrophenyl)pentan-2-one Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4/c1-7(13)11(8(2)14)9-4-3-5-10(6-9)12(15)16/h3-7,11,13H,1-2H3