4-(3-nitrophenyl)-4-oxidanyl-but-3-en-2-one

Systemtic Name: 4-(3-nitrophenyl)-4-oxidanyl-but-3-en-2-one Openeye Name: 4-hydroxy-4-(3-nitrophenyl)but-3-en-2-one CAS Name: 4-hydroxy-4-(3-nitrophenyl)-3-buten-2-one IUPAC Name: 4-hydroxy-4-(3-nitrophenyl)but-3-en-2-one Traditional Name: 4-hydroxy-4-(3-nitrophenyl)but-3-en-2-one Formula: C10H9NO4 MolecularWeight: 207.18276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO4/c1-7(12)5-10(13)8-3-2-4-9(6-8)11(14)15/h2-6,13H,1H3