Chem
J-GLOBAL ID：200907070848635357   Nikkaji number：J2.015.856E

5-(1-Methylquinolinium-3-ylcarbamoyl)-1α,3α,5α-trimethylcyclohexane-1,3-dicarbimide

5-(1-メチルキノリニウム-3-イルカルバモイル)-1α,3α,5α-トリメチルシクロヘキサン-1,3-ジカルボイミド
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： C22H26N2[N+]O3
Molecular formula furigana： C22-H26-N3-O3
Molecular weight： 380.467
InChI： InChI=1S/C22H25N3O3/c1-20(11-21(2)13-22(3,12-20)19(28)24-18(21)27)17(26)23-15-9-14-7-5-6-8-16(14)25(4)10-15/h5-10H,11-13H2,1-4H3,(H-,23,24,26,27,28)/p+1/t20-,21-,22+
InChI key： ZQWRKIVYRQQZNE-DKUWSORSSA-O
SMILES： C[n+]1cc(NC(=O)[C@]2(C)C[C@]3(C)C[C@](C)(C2)C(=O)NC3=O)cc2ccccc12
Systematic name  (3)：
  • 5-(1-メチルキノリニウム-3-イルカルバモイル)-1α,3α,5α-トリメチルシクロヘキサン-1,3-ジカルボイミド
  • 1-メチル-3-[(1R,5S,7r)-1,5,7-トリメチル-2,4-ジオキソ-3-アザビシクロ[3.3.1]ノナン-7-アミド]キノリン-1-イウム
  • 1-methyl-3-[(1R,5S,7r)-1,5,7-trimethyl-2,4-dioxo-3-azabicyclo[3.3.1]nonane-7-amido]quinolin-1-ium
Other name (1)：
  • 5-(1-Methylquinolinium-3-ylcarbamoyl)-1α,3α,5α-trimethylcyclohexane-1,3-dicarbimide
Thsaurus map：
Thesaurus Map

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