Chem
J-GLOBAL ID:201807021356133371   Nikkaji number:J3.729.003C

3-(4-クロロフェニル)-6-メチル-9-オキソ-8-フェニル-1-オキサ-2,7,8-トリアザスピロ[4.4]ノナ-2,6-ジエン-2-イウム-2-オラート

3-(4-クロロフェニル)-6-メチル-9-オキソ-8-フェニル-1-オキサ-2,7,8-トリアザスピロ[4.4]ノナ-2,6-ジエン-2-イウム-2-オラート
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: C18H14ClN2[N+]O2[O-]
Molecular formula furigana: C18-H14-CL-N3-O3
Molecular weight: 355.780
InChI: InChI=1S/C18H14ClN3O3/c1-12-18(17(23)21(20-12)15-5-3-2-4-6-15)11-16(22(24)25-18)13-7-9-14(19)10-8-13/h2-10H,11H2,1H3
InChI key: MFIMWVPQSCLTHR-UHFFFAOYSA-N
SMILES: O1[N+](=C(CC21C(=NN(C2=O)c1ccccc1)C)c1ccc(cc1)Cl)[O-]
Systematic name  (3):
  • 3-(4-クロロフェニル)-8-フェニル-6-メチル-9-オキソ-1-オキサ-2,7,8-トリアザスピロ[4.4]ノナ-2,6-ジエン-2-イウム-2-オラート
  • 3-(4-クロロフェニル)-6-メチル-9-オキソ-8-フェニル-1-オキサ-2,7,8-トリアザスピロ[4.4]ノナ-2,6-ジエン-2-イウム-2-オラート
  • 3-(4-chlorophenyl)-6-methyl-9-oxo-8-phenyl-1-oxa-2,7,8-triazaspiro[4.4]nona-2,6-dien-2-ium-2-olate
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