Chem
J-GLOBAL ID：201107018301449628   Nikkaji number：J2.985.149B

1-Nitro-4-[3-(4-methylphenyl)-2-propynyl]benzene

1-ニトロ-4-[3-(4-メチルフェニル)-2-プロピニル]ベンゼン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C16H13[N+]O[O-]
Molecular formula furigana： C16-H13-N-O2
Molecular weight： 251.285
InChI： InChI=1S/C16H13NO2/c1-13-5-7-14(8-6-13)3-2-4-15-9-11-16(12-10-15)17(18)19/h5-12H,4H2,1H3
InChI key： ZPSSAZLXPDTRSE-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)C#CCc1ccc(cc1)[N+](=O)[O-]
Systematic name  (3)：
  • 1-ニトロ-4-[3-(4-メチルフェニル)-2-プロピニル]ベンゼン
  • 1-メチル-4-[3-(4-ニトロフェニル)プロパ-1-イン-1-イル]ベンゼン
  • 1-methyl-4-[3-(4-nitrophenyl)prop-1-yn-1-yl]benzene
Other name (1)：
  • 1-Nitro-4-[3-(4-methylphenyl)-2-propynyl]benzene
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