Chem
J-GLOBAL ID：200907025777099607   Nikkaji number：J1.324.388C

N-[(9S)-Cinchonan-9-yl]diphenylacetamide

N-[(9S)-シンコナン-9-イル]ジフェニルアセトアミド
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： C33H33N3O
Molecular formula furigana： C33-H33-N3-O
Molecular weight： 487.647
InChI： InChI=1S/C33H33N3O/c1-2-23-22-36-20-18-26(23)21-30(36)32(28-17-19-34-29-16-10-9-15-27(28)29)35-33(37)31(24-11-5-3-6-12-24)25-13-7-4-8-14-25/h2-17,19,23,26,30-32H,1,18,20-22H2,(H,35,37)/t23-,26-,30+,32-/m0/s1
InChI key： WFUGKYOYFIKPFK-VHCUVEKUSA-N
SMILES： C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)c1ccnc2ccccc12
Systematic name  (3)：
  • N-[(9S)-シンコナン-9-イル]ジフェニルアセトアミド
  • 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]-2,2-ジフェニルアセトアミド
  • N-[(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methyl]-2,2-diphenylacetamide
Other name (1)：
  • N-[(9S)-Cinchonan-9-yl]diphenylacetamide
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