Chem
J-GLOBAL ID：200907022541196645   Nikkaji number：J1.324.394H

N-[(9S)-Cinchonan-9-yl]-2,4-cyclohexadiene-1-carboxamide

N-[(9S)-シンコナン-9-イル]-2,4-シクロヘキサジエン-1-カルボアミド
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： C26H29N3O
Molecular formula furigana： C26-H29-N3-O
Molecular weight： 399.538
InChI： InChI=1S/C26H29N3O/c1-2-18-17-29-15-13-20(18)16-24(29)25(28-26(30)19-8-4-3-5-9-19)22-12-14-27-23-11-7-6-10-21(22)23/h2-8,10-12,14,18-20,24-25H,1,9,13,15-17H2,(H,28,30)/t18-,19?,20-,24+,25-/m0/s1
InChI key： OEEGMDLPBJPLEB-XYDBHLIGSA-N
SMILES： C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@@H](NC(=O)C1CC=CC=C1)c1ccnc2ccccc12
Systematic name  (3)：
  • N-[(9S)-シンコナン-9-イル]-2,4-シクロヘキサジエン-1-カルボアミド
  • N-[(S)-[(2R,4S,5R)-5-エテニル-1-アザビシクロ[2.2.2]オクタン-2-イル](キノリン-4-イル)メチル]シクロヘキサ-2,4-ジエン-1-カルボキサミド
  • N-[(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methyl]cyclohexa-2,4-diene-1-carboxamide
Other name (1)：
  • N-[(9S)-Cinchonan-9-yl]-2,4-cyclohexadiene-1-carboxamide
Thsaurus map：
Thesaurus Map

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