4-methyl-2-[(4-nitrophenyl)-oxidanyl-methyl]-4-oxidanyl-pent-1-en-3-one

Systemtic Name: 4-methyl-2-[(4-nitrophenyl)-oxidanyl-methyl]-4-oxidanyl-pent-1-en-3-one Openeye Name: 4-hydroxy-2-[hydroxy-(4-nitrophenyl)methyl]-4-methyl-pent-1-en-3-one CAS Name: 4-hydroxy-2-[hydroxy-(4-nitrophenyl)methyl]-4-methyl-1-penten-3-one IUPAC Name: 4-hydroxy-2-[hydroxy-(4-nitrophenyl)methyl]-4-methylpent-1-en-3-one Traditional Name: 4-hydroxy-2-[hydroxy-(4-nitrophenyl)methyl]-4-methyl-pent-1-en-3-one Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO5/c1-8(12(16)13(2,3)17)11(15)9-4-6-10(7-5-9)14(18)19/h4-7,11,15,17H,1H2,2-3H3