3-methyl-6-(3-nitrophenyl)-6-oxidanyl-hexa-3,4-dien-2-one

Systemtic Name: 3-methyl-6-(3-nitrophenyl)-6-oxidanyl-hexa-3,4-dien-2-one Openeye Name: 6-hydroxy-3-methyl-6-(3-nitrophenyl)hexa-3,4-dien-2-one CAS Name: 6-hydroxy-3-methyl-6-(3-nitrophenyl)-2-hexa-3,4-dienone IUPAC Name: 6-hydroxy-3-methyl-6-(3-nitrophenyl)hexa-3,4-dien-2-one Traditional Name: 6-hydroxy-3-methyl-6-(3-nitrophenyl)hexa-3,4-dien-2-one Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO4/c1-9(10(2)15)6-7-13(16)11-4-3-5-12(8-11)14(17)18/h3-5,7-8,13,16H,1-2H3