Chem
J-GLOBAL ID:201807007619413312
Nikkaji number:J3.681.605H
(3S)-1-Benzoyl-3-methyl-3-((4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)methyl)-5-phenyl-1,2,3,6-tetrahydropyridine
(3S)-1-ベンゾイル-3-メチル-3-((4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)メチル)-5-フェニル-1,2,3,6-テトラヒドロピリジン
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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:
C26 H32 BNO3
Molecular formula furigana:
C26-H32-B-N-O3
Molecular weight:
417.360
InChI:
InChI=1S/C26H32BNO3/c1-24(2)25(3,4)31-27(30-24)18-26(5)16-22(20-12-8-6-9-13-20)17-28(19-26)23(29)21-14-10-7-11-15-21/h6-16H,17-19H2,1-5H3/t26-/m1/s1
InChI key:
IIQGPNMIJQHPBZ-AREMUKBSSA-N
SMILES:
CC1(C)OB(C[C@]2(C)CN(CC(=C2)c2ccccc2)C(=O)c2ccccc2)OC1(C)C
Systematic name (3):
(3S)-1-ベンゾイル-3-メチル-3-((4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)メチル)-5-フェニル-1,2,3,6-テトラヒドロピリジン
(3S)-1-ベンゾイル-3-メチル-5-フェニル-3-[(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)メチル]-1,2,3,6-テトラヒドロピリジン
(3S)-1-benzoyl-3-methyl-5-phenyl-3-[(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl]-1,2,3,6-tetrahydropyridine
Other name (1):
(3S)-1-Benzoyl-3-methyl-3-((4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)methyl)-5-phenyl-1,2,3,6-tetrahydropyridine
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